Running DMFT2 in single processor mode Modus: TOT no read error RECPR LIST: NOFI -------------------------------------------------- S T R U C T U R A L I N F O R M A T I O N -------------------------------------------------- SUBSTANCE = FeSi LATTICE = P LATTICE CONSTANTS ARE = 8.4905400 8.4905400 8.4905400 NUMBER OF ATOMS IN UNITCELL = 2 MODE OF CALCULATION IS = RELA TYPE OF COORDINATES IN DSPLIT= generate new recprlist KXMAX,KYMAX,KZMAX 16 16 16 1508 PLANE WAVES GENERATED (INCLUDING FORBIDDEN H,K,L) nwav1,kn 11111 1508 KVEC( 1) = 0 0 0 0.0000 1 KVEC( 2) = -1 0 0 0.7400 6 KVEC( 3) = -1 -1 0 1.0465 12 KVEC( 4) = -1 -1 -1 1.2818 4 KVEC( 5) = -1 -1 1 1.2818 4 KVEC( 6) = -2 0 0 1.4800 6 KVEC( 7) = -2 -1 0 1.6547 12 KVEC( 8) = -2 0 -1 1.6547 12 KVEC( 9) = -2 -1 -1 1.8127 12 KVEC( 10) = -2 -1 1 1.8127 12 KVEC( 11) = -2 -2 0 2.0931 12 KVEC( 12) = -3 0 0 2.2201 6 KVEC( 13) = -2 -2 -1 2.2201 12 KVEC( 14) = -2 -2 1 2.2201 12 KVEC( 15) = -3 -1 0 2.3402 12 KVEC( 16) = -3 0 -1 2.3402 12 KVEC( 17) = -3 -1 -1 2.4544 12 KVEC( 18) = -3 -1 1 2.4544 12 KVEC( 19) = -2 -2 -2 2.5635 4 KVEC( 20) = -2 -2 2 2.5635 4 KVEC( 21) = -3 -2 0 2.6682 12 KVEC( 22) = -3 0 -2 2.6682 12 KVEC( 23) = -3 -2 -1 2.7689 12 KVEC( 24) = -3 -2 1 2.7689 12 KVEC( 25) = -3 -1 -2 2.7689 12 KVEC( 26) = -3 -1 2 2.7689 12 KVEC( 27) = -4 0 0 2.9601 6 KVEC( 28) = -4 -1 0 3.0512 12 KVEC( 29) = -4 0 -1 3.0512 12 KVEC( 30) = -3 -2 -2 3.0512 12 KVEC( 31) = -3 -2 2 3.0512 12 KVEC( 32) = -4 -1 -1 3.1396 12 KVEC( 33) = -4 -1 1 3.1396 12 KVEC( 34) = -3 -3 0 3.1396 12 KVEC( 35) = -3 -3 -1 3.2257 12 KVEC( 36) = -3 -3 1 3.2257 12 KVEC( 37) = -4 -2 0 3.3095 12 KVEC( 38) = -4 0 -2 3.3095 12 KVEC( 39) = -4 -2 -1 3.3912 12 KVEC( 40) = -4 -2 1 3.3912 12 KVEC( 41) = -4 -1 -2 3.3912 12 KVEC( 42) = -4 -1 2 3.3912 12 KVEC( 43) = -3 -3 -2 3.4710 12 KVEC( 44) = -3 -3 2 3.4710 12 KVEC( 45) = -4 -2 -2 3.6254 12 KVEC( 46) = -4 -2 2 3.6254 12 KVEC( 47) = -5 0 0 3.7001 6 KVEC( 48) = -4 -3 0 3.7001 12 KVEC( 49) = -4 0 -3 3.7001 12 KVEC( 50) = -5 -1 0 3.7734 12 KVEC( 51) = -5 0 -1 3.7734 12 KVEC( 52) = -4 -3 -1 3.7734 12 KVEC( 53) = -4 -3 1 3.7734 12 KVEC( 54) = -4 -1 -3 3.7734 12 KVEC( 55) = -4 -1 3 3.7734 12 KVEC( 56) = -5 -1 -1 3.8453 12 KVEC( 57) = -5 -1 1 3.8453 12 KVEC( 58) = -3 -3 -3 3.8453 4 KVEC( 59) = -3 -3 3 3.8453 4 KVEC( 60) = -5 -2 0 3.9851 12 KVEC( 61) = -5 0 -2 3.9851 12 KVEC( 62) = -4 -3 -2 3.9851 12 KVEC( 63) = -4 -3 2 3.9851 12 KVEC( 64) = -4 -2 -3 3.9851 12 KVEC( 65) = -4 -2 3 3.9851 12 KVEC( 66) = -5 -2 -1 4.0533 12 KVEC( 67) = -5 -2 1 4.0533 12 KVEC( 68) = -5 -1 -2 4.0533 12 KVEC( 69) = -5 -1 2 4.0533 12 KVEC( 70) = -4 -4 0 4.1862 12 KVEC( 71) = -5 -2 -2 4.2511 12 KVEC( 72) = -5 -2 2 4.2511 12 KVEC( 73) = -4 -4 -1 4.2511 12 KVEC( 74) = -4 -4 1 4.2511 12 KVEC( 75) = -5 -3 0 4.3150 12 KVEC( 76) = -5 0 -3 4.3150 12 KVEC( 77) = -4 -3 -3 4.3150 12 KVEC( 78) = -4 -3 3 4.3150 12 KVEC( 79) = -5 -3 -1 4.3780 12 KVEC( 80) = -5 -3 1 4.3780 12 KVEC( 81) = -5 -1 -3 4.3780 12 KVEC( 82) = -5 -1 3 4.3780 12 KVEC( 83) = -6 0 0 4.4401 6 KVEC( 84) = -4 -4 -2 4.4401 12 KVEC( 85) = -4 -4 2 4.4401 12 KVEC( 86) = -6 -1 0 4.5014 12 KVEC( 87) = -6 0 -1 4.5014 12 KVEC( 88) = -6 -1 -1 4.5618 12 KVEC( 89) = -6 -1 1 4.5618 12 KVEC( 90) = -5 -3 -2 4.5618 12 KVEC( 91) = -5 -3 2 4.5618 12 KVEC( 92) = -5 -2 -3 4.5618 12 KVEC( 93) = -5 -2 3 4.5618 12 KVEC( 94) = -6 -2 0 4.6803 12 KVEC( 95) = -6 0 -2 4.6803 12 KVEC( 96) = -6 -2 -1 4.7385 12 KVEC( 97) = -6 -2 1 4.7385 12 KVEC( 98) = -6 -1 -2 4.7385 12 KVEC( 99) = -6 -1 2 4.7385 12 KVEC( 100) = -5 -4 0 4.7385 12 KVEC( 101) = -5 0 -4 4.7385 12 KVEC( 102) = -4 -4 -3 4.7385 12 KVEC( 103) = -4 -4 3 4.7385 12 KVEC( 104) = -5 -4 -1 4.7959 12 KVEC( 105) = -5 -4 1 4.7959 12 KVEC( 106) = -5 -1 -4 4.7959 12 KVEC( 107) = -5 -1 4 4.7959 12 KVEC( 108) = -5 -3 -3 4.8526 12 KVEC( 109) = -5 -3 3 4.8526 12 KVEC( 110) = -6 -2 -2 4.9087 12 KVEC( 111) = -6 -2 2 4.9087 12 KVEC( 112) = -6 -3 0 4.9642 12 KVEC( 113) = -6 0 -3 4.9642 12 KVEC( 114) = -5 -4 -2 4.9642 12 KVEC( 115) = -5 -4 2 4.9642 12 KVEC( 116) = -5 -2 -4 4.9642 12 KVEC( 117) = -5 -2 4 4.9642 12 KVEC( 118) = -6 -3 -1 5.0191 12 KVEC( 119) = -6 -3 1 5.0191 12 KVEC( 120) = -6 -1 -3 5.0191 12 KVEC( 121) = -6 -1 3 5.0191 12 KVEC( 122) = -4 -4 -4 5.1270 4 KVEC( 123) = -4 -4 4 5.1270 4 KVEC( 124) = -7 0 0 5.1802 6 KVEC( 125) = -6 -3 -2 5.1802 12 KVEC( 126) = -6 -3 2 5.1802 12 KVEC( 127) = -6 -2 -3 5.1802 12 KVEC( 128) = -6 -2 3 5.1802 12 KVEC( 129) = -7 -1 0 5.2327 12 KVEC( 130) = -7 0 -1 5.2327 12 KVEC( 131) = -5 -5 0 5.2327 12 KVEC( 132) = -5 -4 -3 5.2327 12 KVEC( 133) = -5 -4 3 5.2327 12 KVEC( 134) = -5 -3 -4 5.2327 12 KVEC( 135) = -5 -3 4 5.2327 12 KVEC( 136) = -7 -1 -1 5.2848 12 KVEC( 137) = -7 -1 1 5.2848 12 KVEC( 138) = -5 -5 -1 5.2848 12 KVEC( 139) = -5 -5 1 5.2848 12 KVEC( 140) = -6 -4 0 5.3364 12 KVEC( 141) = -6 0 -4 5.3364 12 KVEC( 142) = -7 -2 0 5.3874 12 KVEC( 143) = -7 0 -2 5.3874 12 KVEC( 144) = -6 -4 -1 5.3874 12 KVEC( 145) = -6 -4 1 5.3874 12 KVEC( 146) = -6 -1 -4 5.3874 12 KVEC( 147) = -6 -1 4 5.3874 12 KVEC( 148) = -7 -2 -1 5.4380 12 KVEC( 149) = -7 -2 1 5.4380 12 KVEC( 150) = -7 -1 -2 5.4380 12 KVEC( 151) = -7 -1 2 5.4380 12 KVEC( 152) = -6 -3 -3 5.4380 12 KVEC( 153) = -6 -3 3 5.4380 12 KVEC( 154) = -5 -5 -2 5.4380 12 KVEC( 155) = -5 -5 2 5.4380 12 KVEC( 156) = -6 -4 -2 5.5378 12 KVEC( 157) = -6 -4 2 5.5378 12 KVEC( 158) = -6 -2 -4 5.5378 12 KVEC( 159) = -6 -2 4 5.5378 12 KVEC( 160) = -7 -2 -2 5.5870 12 KVEC( 161) = -7 -2 2 5.5870 12 KVEC( 162) = -5 -4 -4 5.5870 12 KVEC( 163) = -5 -4 4 5.5870 12 KVEC( 164) = -7 -3 0 5.6358 12 KVEC( 165) = -7 0 -3 5.6358 12 KVEC( 166) = -7 -3 -1 5.6842 12 KVEC( 167) = -7 -3 1 5.6842 12 KVEC( 168) = -7 -1 -3 5.6842 12 KVEC( 169) = -7 -1 3 5.6842 12 KVEC( 170) = -5 -5 -3 5.6842 12 KVEC( 171) = -5 -5 3 5.6842 12 KVEC( 172) = -6 -5 0 5.7798 12 KVEC( 173) = -6 -4 -3 5.7798 12 KVEC( 174) = -6 -4 3 5.7798 12 KVEC( 175) = -6 -3 -4 5.7798 12 KVEC( 176) = -6 -3 4 5.7798 12 KVEC( 177) = -6 0 -5 5.7798 12 KVEC( 178) = -7 -3 -2 5.8269 12 KVEC( 179) = -7 -3 2 5.8269 12 KVEC( 180) = -7 -2 -3 5.8269 12 KVEC( 181) = -7 -2 3 5.8269 12 KVEC( 182) = -6 -5 -1 5.8269 12 KVEC( 183) = -6 -5 1 5.8269 12 KVEC( 184) = -6 -1 -5 5.8269 12 KVEC( 185) = -6 -1 5 5.8269 12 KVEC( 186) = -8 0 0 5.9202 6 KVEC( 187) = -8 -1 0 5.9662 12 KVEC( 188) = -8 0 -1 5.9662 12 KVEC( 189) = -7 -4 0 5.9662 12 KVEC( 190) = -7 0 -4 5.9662 12 KVEC( 191) = -6 -5 -2 5.9662 12 KVEC( 192) = -6 -5 2 5.9662 12 KVEC( 193) = -6 -2 -5 5.9662 12 KVEC( 194) = -6 -2 5 5.9662 12 KVEC( 195) = -8 -1 -1 6.0120 12 KVEC( 196) = -8 -1 1 6.0120 12 KVEC( 197) = -7 -4 -1 6.0120 12 KVEC( 198) = -7 -4 1 6.0120 12 KVEC( 199) = -7 -1 -4 6.0120 12 KVEC( 200) = -7 -1 4 6.0120 12 KVEC( 201) = -5 -5 -4 6.0120 12 KVEC( 202) = -5 -5 4 6.0120 12 KVEC( 203) = -7 -3 -3 6.0573 12 KVEC( 204) = -7 -3 3 6.0573 12 KVEC( 205) = -8 -2 0 6.1024 12 KVEC( 206) = -8 0 -2 6.1024 12 KVEC( 207) = -6 -4 -4 6.1024 12 KVEC( 208) = -6 -4 4 6.1024 12 KVEC( 209) = -8 -2 -1 6.1471 12 KVEC( 210) = -8 -2 1 6.1471 12 KVEC( 211) = -8 -1 -2 6.1471 12 KVEC( 212) = -8 -1 2 6.1471 12 KVEC( 213) = -7 -4 -2 6.1471 12 KVEC( 214) = -7 -4 2 6.1471 12 KVEC( 215) = -7 -2 -4 6.1471 12 KVEC( 216) = -7 -2 4 6.1471 12 KVEC( 217) = -6 -5 -3 6.1915 12 KVEC( 218) = -6 -5 3 6.1915 12 KVEC( 219) = -6 -3 -5 6.1915 12 KVEC( 220) = -6 -3 5 6.1915 12 KVEC( 221) = -8 -2 -2 6.2793 12 KVEC( 222) = -8 -2 2 6.2793 12 KVEC( 223) = -6 -6 0 6.2793 12 KVEC( 224) = -8 -3 0 6.3227 12 KVEC( 225) = -8 0 -3 6.3227 12 KVEC( 226) = -6 -6 -1 6.3227 12 KVEC( 227) = -6 -6 1 6.3227 12 KVEC( 228) = -8 -3 -1 6.3659 12 KVEC( 229) = -8 -3 1 6.3659 12 KVEC( 230) = -8 -1 -3 6.3659 12 KVEC( 231) = -8 -1 3 6.3659 12 KVEC( 232) = -7 -5 0 6.3659 12 KVEC( 233) = -7 -4 -3 6.3659 12 KVEC( 234) = -7 -4 3 6.3659 12 KVEC( 235) = -7 -3 -4 6.3659 12 KVEC( 236) = -7 -3 4 6.3659 12 KVEC( 237) = -7 0 -5 6.3659 12 KVEC( 238) = -7 -5 -1 6.4088 12 KVEC( 239) = -7 -5 1 6.4088 12 KVEC( 240) = -7 -1 -5 6.4088 12 KVEC( 241) = -7 -1 5 6.4088 12 KVEC( 242) = -5 -5 -5 6.4088 4 KVEC( 243) = -5 -5 5 6.4088 4 KVEC( 244) = -6 -6 -2 6.4514 12 KVEC( 245) = -6 -6 2 6.4514 12 KVEC( 246) = -8 -3 -2 6.4937 12 KVEC( 247) = -8 -3 2 6.4937 12 KVEC( 248) = -8 -2 -3 6.4937 12 KVEC( 249) = -8 -2 3 6.4937 12 KVEC( 250) = -6 -5 -4 6.4937 12 KVEC( 251) = -6 -5 4 6.4937 12 KVEC( 252) = -6 -4 -5 6.4937 12 KVEC( 253) = -6 -4 5 6.4937 12 KVEC( 254) = -7 -5 -2 6.5357 12 KVEC( 255) = -7 -5 2 6.5357 12 KVEC( 256) = -7 -2 -5 6.5357 12 KVEC( 257) = -7 -2 5 6.5357 12 KVEC( 258) = -8 -4 0 6.6190 12 KVEC( 259) = -8 0 -4 6.6190 12 KVEC( 260) = -9 0 0 6.6602 6 KVEC( 261) = -8 -4 -1 6.6602 12 KVEC( 262) = -8 -4 1 6.6602 12 KVEC( 263) = -8 -1 -4 6.6602 12 KVEC( 264) = -8 -1 4 6.6602 12 KVEC( 265) = -7 -4 -4 6.6602 12 KVEC( 266) = -7 -4 4 6.6602 12 KVEC( 267) = -6 -6 -3 6.6602 12 KVEC( 268) = -6 -6 3 6.6602 12 KVEC( 269) = -9 -1 0 6.7012 12 KVEC( 270) = -9 0 -1 6.7012 12 KVEC( 271) = -8 -3 -3 6.7012 12 KVEC( 272) = -8 -3 3 6.7012 12 KVEC( 273) = -9 -1 -1 6.7419 12 KVEC( 274) = -9 -1 1 6.7419 12 KVEC( 275) = -7 -5 -3 6.7419 12 KVEC( 276) = -7 -5 3 6.7419 12 KVEC( 277) = -7 -3 -5 6.7419 12 KVEC( 278) = -7 -3 5 6.7419 12 KVEC( 279) = -8 -4 -2 6.7824 12 KVEC( 280) = -8 -4 2 6.7824 12 KVEC( 281) = -8 -2 -4 6.7824 12 KVEC( 282) = -8 -2 4 6.7824 12 KVEC( 283) = -9 -2 0 6.8227 12 KVEC( 284) = -9 0 -2 6.8227 12 KVEC( 285) = -7 -6 0 6.8227 12 KVEC( 286) = -7 0 -6 6.8227 12 KVEC( 287) = -9 -2 -1 6.8627 12 KVEC( 288) = -9 -2 1 6.8627 12 KVEC( 289) = -9 -1 -2 6.8627 12 KVEC( 290) = -9 -1 2 6.8627 12 KVEC( 291) = -7 -6 -1 6.8627 12 KVEC( 292) = -7 -6 1 6.8627 12 KVEC( 293) = -7 -1 -6 6.8627 12 KVEC( 294) = -7 -1 6 6.8627 12 KVEC( 295) = -6 -5 -5 6.8627 12 KVEC( 296) = -6 -5 5 6.8627 12 KVEC( 297) = -6 -6 -4 6.9420 12 KVEC( 298) = -6 -6 4 6.9420 12 KVEC( 299) = -9 -2 -2 6.9814 12 KVEC( 300) = -9 -2 2 6.9814 12 KVEC( 301) = -8 -5 0 6.9814 12 KVEC( 302) = -8 -4 -3 6.9814 12 KVEC( 303) = -8 -4 3 6.9814 12 KVEC( 304) = -8 -3 -4 6.9814 12 KVEC( 305) = -8 -3 4 6.9814 12 KVEC( 306) = -8 0 -5 6.9814 12 KVEC( 307) = -7 -6 -2 6.9814 12 KVEC( 308) = -7 -6 2 6.9814 12 KVEC( 309) = -7 -2 -6 6.9814 12 KVEC( 310) = -7 -2 6 6.9814 12 KVEC( 311) = -9 -3 0 7.0205 12 KVEC( 312) = -9 0 -3 7.0205 12 KVEC( 313) = -8 -5 -1 7.0205 12 KVEC( 314) = -8 -5 1 7.0205 12 KVEC( 315) = -8 -1 -5 7.0205 12 KVEC( 316) = -8 -1 5 7.0205 12 KVEC( 317) = -7 -5 -4 7.0205 12 KVEC( 318) = -7 -5 4 7.0205 12 KVEC( 319) = -7 -4 -5 7.0205 12 KVEC( 320) = -7 -4 5 7.0205 12 KVEC( 321) = -9 -3 -1 7.0594 12 KVEC( 322) = -9 -3 1 7.0594 12 KVEC( 323) = -9 -1 -3 7.0594 12 KVEC( 324) = -9 -1 3 7.0594 12 KVEC( 325) = -8 -5 -2 7.1365 12 KVEC( 326) = -8 -5 2 7.1365 12 KVEC( 327) = -8 -2 -5 7.1365 12 KVEC( 328) = -8 -2 5 7.1365 12 KVEC( 329) = -9 -3 -2 7.1748 12 KVEC( 330) = -9 -3 2 7.1748 12 KVEC( 331) = -9 -2 -3 7.1748 12 KVEC( 332) = -9 -2 3 7.1748 12 KVEC( 333) = -7 -6 -3 7.1748 12 KVEC( 334) = -7 -6 3 7.1748 12 KVEC( 335) = -7 -3 -6 7.1748 12 KVEC( 336) = -7 -3 6 7.1748 12 KVEC( 337) = -8 -4 -4 7.2507 12 KVEC( 338) = -8 -4 4 7.2507 12 KVEC( 339) = -9 -4 0 7.2884 12 KVEC( 340) = -9 0 -4 7.2884 12 KVEC( 341) = -6 -6 -5 7.2884 12 KVEC( 342) = -6 -6 5 7.2884 12 KVEC( 343) = -9 -4 -1 7.3258 12 KVEC( 344) = -9 -4 1 7.3258 12 KVEC( 345) = -9 -1 -4 7.3258 12 KVEC( 346) = -9 -1 4 7.3258 12 KVEC( 347) = -8 -5 -3 7.3258 12 KVEC( 348) = -8 -5 3 7.3258 12 KVEC( 349) = -8 -3 -5 7.3258 12 KVEC( 350) = -8 -3 5 7.3258 12 KVEC( 351) = -7 -7 0 7.3258 12 KVEC( 352) = -9 -3 -3 7.3631 12 KVEC( 353) = -9 -3 3 7.3631 12 KVEC( 354) = -7 -7 -1 7.3631 12 KVEC( 355) = -7 -7 1 7.3631 12 KVEC( 356) = -7 -5 -5 7.3631 12 KVEC( 357) = -7 -5 5 7.3631 12 KVEC( 358) = -10 0 0 7.4002 6 KVEC( 359) = -8 -6 0 7.4002 12 KVEC( 360) = -8 0 -6 7.4002 12 KVEC( 361) = -10 -1 0 7.4371 12 KVEC( 362) = -10 0 -1 7.4371 12 KVEC( 363) = -9 -4 -2 7.4371 12 KVEC( 364) = -9 -4 2 7.4371 12 KVEC( 365) = -9 -2 -4 7.4371 12 KVEC( 366) = -9 -2 4 7.4371 12 KVEC( 367) = -8 -6 -1 7.4371 12 KVEC( 368) = -8 -6 1 7.4371 12 KVEC( 369) = -8 -1 -6 7.4371 12 KVEC( 370) = -8 -1 6 7.4371 12 KVEC( 371) = -7 -6 -4 7.4371 12 KVEC( 372) = -7 -6 4 7.4371 12 KVEC( 373) = -7 -4 -6 7.4371 12 KVEC( 374) = -7 -4 6 7.4371 12 KVEC( 375) = -10 -1 -1 7.4739 12 KVEC( 376) = -10 -1 1 7.4739 12 KVEC( 377) = -7 -7 -2 7.4739 12 KVEC( 378) = -7 -7 2 7.4739 12 KVEC( 379) = -10 -2 0 7.5468 12 KVEC( 380) = -10 0 -2 7.5468 12 KVEC( 381) = -8 -6 -2 7.5468 12 KVEC( 382) = -8 -6 2 7.5468 12 KVEC( 383) = -8 -2 -6 7.5468 12 KVEC( 384) = -8 -2 6 7.5468 12 KVEC( 385) = -10 -2 -1 7.5830 12 KVEC( 386) = -10 -2 1 7.5830 12 KVEC( 387) = -10 -1 -2 7.5830 12 KVEC( 388) = -10 -1 2 7.5830 12 KVEC( 389) = -8 -5 -4 7.5830 12 KVEC( 390) = -8 -5 4 7.5830 12 KVEC( 391) = -8 -4 -5 7.5830 12 KVEC( 392) = -8 -4 5 7.5830 12 KVEC( 393) = -9 -5 0 7.6190 12 KVEC( 394) = -9 -4 -3 7.6190 12 KVEC( 395) = -9 -4 3 7.6190 12 KVEC( 396) = -9 -3 -4 7.6190 12 KVEC( 397) = -9 -3 4 7.6190 12 KVEC( 398) = -9 0 -5 7.6190 12 KVEC( 399) = -9 -5 -1 7.6548 12 KVEC( 400) = -9 -5 1 7.6548 12 KVEC( 401) = -9 -1 -5 7.6548 12 KVEC( 402) = -9 -1 5 7.6548 12 KVEC( 403) = -7 -7 -3 7.6548 12 KVEC( 404) = -7 -7 3 7.6548 12 KVEC( 405) = -10 -2 -2 7.6905 12 KVEC( 406) = -10 -2 2 7.6905 12 KVEC( 407) = -6 -6 -6 7.6905 4 KVEC( 408) = -6 -6 6 7.6905 4 KVEC( 409) = -10 -3 0 7.7261 12 KVEC( 410) = -10 0 -3 7.7261 12 KVEC( 411) = -8 -6 -3 7.7261 12 KVEC( 412) = -8 -6 3 7.7261 12 KVEC( 413) = -8 -3 -6 7.7261 12 KVEC( 414) = -8 -3 6 7.7261 12 KVEC( 415) = -10 -3 -1 7.7614 12 KVEC( 416) = -10 -3 1 7.7614 12 KVEC( 417) = -10 -1 -3 7.7614 12 KVEC( 418) = -10 -1 3 7.7614 12 KVEC( 419) = -9 -5 -2 7.7614 12 KVEC( 420) = -9 -5 2 7.7614 12 KVEC( 421) = -9 -2 -5 7.7614 12 KVEC( 422) = -9 -2 5 7.7614 12 KVEC( 423) = -7 -6 -5 7.7614 12 KVEC( 424) = -7 -6 5 7.7614 12 KVEC( 425) = -7 -5 -6 7.7614 12 KVEC( 426) = -7 -5 6 7.7614 12 KVEC( 427) = -10 -3 -2 7.8665 12 KVEC( 428) = -10 -3 2 7.8665 12 KVEC( 429) = -10 -2 -3 7.8665 12 KVEC( 430) = -10 -2 3 7.8665 12 KVEC( 431) = -9 -4 -4 7.8665 12 KVEC( 432) = -9 -4 4 7.8665 12 KVEC( 433) = -8 -7 0 7.8665 12 KVEC( 434) = -8 0 -7 7.8665 12 KVEC( 435) = -8 -7 -1 7.9013 12 KVEC( 436) = -8 -7 1 7.9013 12 KVEC( 437) = -8 -5 -5 7.9013 12 KVEC( 438) = -8 -5 5 7.9013 12 KVEC( 439) = -8 -1 -7 7.9013 12 KVEC( 440) = -8 -1 7 7.9013 12 KVEC( 441) = -7 -7 -4 7.9013 12 KVEC( 442) = -7 -7 4 7.9013 12 KVEC( 443) = -9 -5 -3 7.9359 12 KVEC( 444) = -9 -5 3 7.9359 12 KVEC( 445) = -9 -3 -5 7.9359 12 KVEC( 446) = -9 -3 5 7.9359 12 KVEC( 447) = -10 -4 0 7.9703 12 KVEC( 448) = -10 0 -4 7.9703 12 KVEC( 449) = -8 -6 -4 7.9703 12 KVEC( 450) = -8 -6 4 7.9703 12 KVEC( 451) = -8 -4 -6 7.9703 12 KVEC( 452) = -8 -4 6 7.9703 12 KVEC( 453) = -10 -4 -1 8.0046 12 KVEC( 454) = -10 -4 1 8.0046 12 KVEC( 455) = -10 -1 -4 8.0046 12 KVEC( 456) = -10 -1 4 8.0046 12 KVEC( 457) = -9 -6 0 8.0046 12 KVEC( 458) = -9 0 -6 8.0046 12 KVEC( 459) = -8 -7 -2 8.0046 12 KVEC( 460) = -8 -7 2 8.0046 12 KVEC( 461) = -8 -2 -7 8.0046 12 KVEC( 462) = -8 -2 7 8.0046 12 KVEC( 463) = -10 -3 -3 8.0387 12 KVEC( 464) = -10 -3 3 8.0387 12 KVEC( 465) = -9 -6 -1 8.0387 12 KVEC( 466) = -9 -6 1 8.0387 12 KVEC( 467) = -9 -1 -6 8.0387 12 KVEC( 468) = -9 -1 6 8.0387 12 KVEC( 469) = -10 -4 -2 8.1065 12 KVEC( 470) = -10 -4 2 8.1065 12 KVEC( 471) = -10 -2 -4 8.1065 12 KVEC( 472) = -10 -2 4 8.1065 12 KVEC( 473) = -11 0 0 8.1402 6 KVEC( 474) = -9 -6 -2 8.1402 12 KVEC( 475) = -9 -6 2 8.1402 12 KVEC( 476) = -9 -2 -6 8.1402 12 KVEC( 477) = -9 -2 6 8.1402 12 KVEC( 478) = -7 -6 -6 8.1402 12 KVEC( 479) = -7 -6 6 8.1402 12 KVEC( 480) = -11 -1 0 8.1738 12 KVEC( 481) = -11 0 -1 8.1738 12 KVEC( 482) = -9 -5 -4 8.1738 12 KVEC( 483) = -9 -5 4 8.1738 12 KVEC( 484) = -9 -4 -5 8.1738 12 KVEC( 485) = -9 -4 5 8.1738 12 KVEC( 486) = -8 -7 -3 8.1738 12 KVEC( 487) = -8 -7 3 8.1738 12 KVEC( 488) = -8 -3 -7 8.1738 12 KVEC( 489) = -8 -3 7 8.1738 12 KVEC( 490) = -11 -1 -1 8.2072 12 KVEC( 491) = -11 -1 1 8.2072 12 KVEC( 492) = -7 -7 -5 8.2072 12 KVEC( 493) = -7 -7 5 8.2072 12 KVEC( 494) = -11 -2 0 8.2737 12 KVEC( 495) = -11 0 -2 8.2737 12 KVEC( 496) = -10 -5 0 8.2737 12 KVEC( 497) = -10 -4 -3 8.2737 12 KVEC( 498) = -10 -4 3 8.2737 12 KVEC( 499) = -10 -3 -4 8.2737 12 KVEC( 500) = -10 -3 4 8.2737 12 KVEC( 501) = -10 0 -5 8.2737 12 KVEC( 502) = -8 -6 -5 8.2737 12 KVEC( 503) = -8 -6 5 8.2737 12 KVEC( 504) = -8 -5 -6 8.2737 12 KVEC( 505) = -8 -5 6 8.2737 12 KVEC( 506) = -11 -2 -1 8.3067 12 KVEC( 507) = -11 -2 1 8.3067 12 KVEC( 508) = -11 -1 -2 8.3067 12 KVEC( 509) = -11 -1 2 8.3067 12 KVEC( 510) = -10 -5 -1 8.3067 12 KVEC( 511) = -10 -5 1 8.3067 12 KVEC( 512) = -10 -1 -5 8.3067 12 KVEC( 513) = -10 -1 5 8.3067 12 KVEC( 514) = -9 -6 -3 8.3067 12 KVEC( 515) = -9 -6 3 8.3067 12 KVEC( 516) = -9 -3 -6 8.3067 12 KVEC( 517) = -9 -3 6 8.3067 12 KVEC( 518) = -8 -8 0 8.3724 12 KVEC( 519) = -11 -2 -2 8.4050 12 KVEC( 520) = -11 -2 2 8.4050 12 KVEC( 521) = -10 -5 -2 8.4050 12 KVEC( 522) = -10 -5 2 8.4050 12 KVEC( 523) = -10 -2 -5 8.4050 12 KVEC( 524) = -10 -2 5 8.4050 12 KVEC( 525) = -8 -8 -1 8.4050 12 KVEC( 526) = -8 -8 1 8.4050 12 KVEC( 527) = -8 -7 -4 8.4050 12 KVEC( 528) = -8 -7 4 8.4050 12 KVEC( 529) = -8 -4 -7 8.4050 12 KVEC( 530) = -8 -4 7 8.4050 12 KVEC( 531) = -11 -3 0 8.4375 12 KVEC( 532) = -11 0 -3 8.4375 12 KVEC( 533) = -9 -7 0 8.4375 12 KVEC( 534) = -9 0 -7 8.4375 12 KVEC( 535) = -11 -3 -1 8.4699 12 KVEC( 536) = -11 -3 1 8.4699 12 KVEC( 537) = -11 -1 -3 8.4699 12 KVEC( 538) = -11 -1 3 8.4699 12 KVEC( 539) = -9 -7 -1 8.4699 12 KVEC( 540) = -9 -7 1 8.4699 12 KVEC( 541) = -9 -5 -5 8.4699 12 KVEC( 542) = -9 -5 5 8.4699 12 KVEC( 543) = -9 -1 -7 8.4699 12 KVEC( 544) = -9 -1 7 8.4699 12 KVEC( 545) = -10 -4 -4 8.5022 12 KVEC( 546) = -10 -4 4 8.5022 12 KVEC( 547) = -8 -8 -2 8.5022 12 KVEC( 548) = -8 -8 2 8.5022 12 KVEC( 549) = -9 -6 -4 8.5343 12 KVEC( 550) = -9 -6 4 8.5343 12 KVEC( 551) = -9 -4 -6 8.5343 12 KVEC( 552) = -9 -4 6 8.5343 12 KVEC( 553) = -11 -3 -2 8.5664 12 KVEC( 554) = -11 -3 2 8.5664 12 KVEC( 555) = -11 -2 -3 8.5664 12 KVEC( 556) = -11 -2 3 8.5664 12 KVEC( 557) = -10 -5 -3 8.5664 12 KVEC( 558) = -10 -5 3 8.5664 12 KVEC( 559) = -10 -3 -5 8.5664 12 KVEC( 560) = -10 -3 5 8.5664 12 KVEC( 561) = -9 -7 -2 8.5664 12 KVEC( 562) = -9 -7 2 8.5664 12 KVEC( 563) = -9 -2 -7 8.5664 12 KVEC( 564) = -9 -2 7 8.5664 12 KVEC( 565) = -7 -7 -6 8.5664 12 KVEC( 566) = -7 -7 6 8.5664 12 KVEC( 567) = -10 -6 0 8.6301 12 KVEC( 568) = -10 0 -6 8.6301 12 KVEC( 569) = -8 -6 -6 8.6301 12 KVEC( 570) = -8 -6 6 8.6301 12 KVEC( 571) = -11 -4 0 8.6617 12 KVEC( 572) = -11 0 -4 8.6617 12 KVEC( 573) = -10 -6 -1 8.6617 12 KVEC( 574) = -10 -6 1 8.6617 12 KVEC( 575) = -10 -1 -6 8.6617 12 KVEC( 576) = -10 -1 6 8.6617 12 KVEC( 577) = -8 -8 -3 8.6617 12 KVEC( 578) = -8 -8 3 8.6617 12 KVEC( 579) = -11 -4 -1 8.6933 12 KVEC( 580) = -11 -4 1 8.6933 12 KVEC( 581) = -11 -1 -4 8.6933 12 KVEC( 582) = -11 -1 4 8.6933 12 KVEC( 583) = -8 -7 -5 8.6933 12 KVEC( 584) = -8 -7 5 8.6933 12 KVEC( 585) = -8 -5 -7 8.6933 12 KVEC( 586) = -8 -5 7 8.6933 12 KVEC( 587) = -11 -3 -3 8.7247 12 KVEC( 588) = -11 -3 3 8.7247 12 KVEC( 589) = -9 -7 -3 8.7247 12 KVEC( 590) = -9 -7 3 8.7247 12 KVEC( 591) = -9 -3 -7 8.7247 12 KVEC( 592) = -9 -3 7 8.7247 12 KVEC( 593) = -10 -6 -2 8.7561 12 KVEC( 594) = -10 -6 2 8.7561 12 KVEC( 595) = -10 -2 -6 8.7561 12 KVEC( 596) = -10 -2 6 8.7561 12 KVEC( 597) = -11 -4 -2 8.7873 12 KVEC( 598) = -11 -4 2 8.7873 12 KVEC( 599) = -11 -2 -4 8.7873 12 KVEC( 600) = -11 -2 4 8.7873 12 KVEC( 601) = -10 -5 -4 8.7873 12 KVEC( 602) = -10 -5 4 8.7873 12 KVEC( 603) = -10 -4 -5 8.7873 12 KVEC( 604) = -10 -4 5 8.7873 12 KVEC( 605) = -9 -6 -5 8.8184 12 KVEC( 606) = -9 -6 5 8.8184 12 KVEC( 607) = -9 -5 -6 8.8184 12 KVEC( 608) = -9 -5 6 8.8184 12 KVEC( 609) = -12 0 0 8.8803 6 KVEC( 610) = -8 -8 -4 8.8803 12 KVEC( 611) = -8 -8 4 8.8803 12 KVEC( 612) = -12 -1 0 8.9110 12 KVEC( 613) = -12 0 -1 8.9110 12 KVEC( 614) = -10 -6 -3 8.9110 12 KVEC( 615) = -10 -6 3 8.9110 12 KVEC( 616) = -10 -3 -6 8.9110 12 KVEC( 617) = -10 -3 6 8.9110 12 KVEC( 618) = -9 -8 0 8.9110 12 KVEC( 619) = -9 0 -8 8.9110 12 KVEC( 620) = -12 -1 -1 8.9417 12 KVEC( 621) = -12 -1 1 8.9417 12 KVEC( 622) = -11 -5 0 8.9417 12 KVEC( 623) = -11 -4 -3 8.9417 12 KVEC( 624) = -11 -4 3 8.9417 12 KVEC( 625) = -11 -3 -4 8.9417 12 KVEC( 626) = -11 -3 4 8.9417 12 KVEC( 627) = -11 0 -5 8.9417 12 KVEC( 628) = -9 -8 -1 8.9417 12 KVEC( 629) = -9 -8 1 8.9417 12 KVEC( 630) = -9 -7 -4 8.9417 12 KVEC( 631) = -9 -7 4 8.9417 12 KVEC( 632) = -9 -4 -7 8.9417 12 KVEC( 633) = -9 -4 7 8.9417 12 KVEC( 634) = -9 -1 -8 8.9417 12 KVEC( 635) = -9 -1 8 8.9417 12 KVEC( 636) = -11 -5 -1 8.9723 12 KVEC( 637) = -11 -5 1 8.9723 12 KVEC( 638) = -11 -1 -5 8.9723 12 KVEC( 639) = -11 -1 5 8.9723 12 KVEC( 640) = -7 -7 -7 8.9723 4 KVEC( 641) = -7 -7 7 8.9723 4 KVEC( 642) = -12 -2 0 9.0028 12 KVEC( 643) = -12 0 -2 9.0028 12 KVEC( 644) = -12 -2 -1 9.0331 12 KVEC( 645) = -12 -2 1 9.0331 12 KVEC( 646) = -12 -1 -2 9.0331 12 KVEC( 647) = -12 -1 2 9.0331 12 KVEC( 648) = -10 -7 0 9.0331 12 KVEC( 649) = -10 0 -7 9.0331 12 KVEC( 650) = -9 -8 -2 9.0331 12 KVEC( 651) = -9 -8 2 9.0331 12 KVEC( 652) = -9 -2 -8 9.0331 12 KVEC( 653) = -9 -2 8 9.0331 12 KVEC( 654) = -8 -7 -6 9.0331 12 KVEC( 655) = -8 -7 6 9.0331 12 KVEC( 656) = -8 -6 -7 9.0331 12 KVEC( 657) = -8 -6 7 9.0331 12 KVEC( 658) = -11 -5 -2 9.0634 12 KVEC( 659) = -11 -5 2 9.0634 12 KVEC( 660) = -11 -2 -5 9.0634 12 KVEC( 661) = -11 -2 5 9.0634 12 KVEC( 662) = -10 -7 -1 9.0634 12 KVEC( 663) = -10 -7 1 9.0634 12 KVEC( 664) = -10 -5 -5 9.0634 12 KVEC( 665) = -10 -5 5 9.0634 12 KVEC( 666) = -10 -1 -7 9.0634 12 KVEC( 667) = -10 -1 7 9.0634 12 KVEC( 668) = -12 -2 -2 9.1236 12 KVEC( 669) = -12 -2 2 9.1236 12 KVEC( 670) = -10 -6 -4 9.1236 12 KVEC( 671) = -10 -6 4 9.1236 12 KVEC( 672) = -10 -4 -6 9.1236 12 KVEC( 673) = -10 -4 6 9.1236 12 KVEC( 674) = -12 -3 0 9.1536 12 KVEC( 675) = -12 0 -3 9.1536 12 KVEC( 676) = -11 -4 -4 9.1536 12 KVEC( 677) = -11 -4 4 9.1536 12 KVEC( 678) = -10 -7 -2 9.1536 12 KVEC( 679) = -10 -7 2 9.1536 12 KVEC( 680) = -10 -2 -7 9.1536 12 KVEC( 681) = -10 -2 7 9.1536 12 KVEC( 682) = -9 -6 -6 9.1536 12 KVEC( 683) = -9 -6 6 9.1536 12 KVEC( 684) = -8 -8 -5 9.1536 12 KVEC( 685) = -8 -8 5 9.1536 12 KVEC( 686) = -12 -3 -1 9.1834 12 KVEC( 687) = -12 -3 1 9.1834 12 KVEC( 688) = -12 -1 -3 9.1834 12 KVEC( 689) = -12 -1 3 9.1834 12 KVEC( 690) = -9 -8 -3 9.1834 12 KVEC( 691) = -9 -8 3 9.1834 12 KVEC( 692) = -9 -3 -8 9.1834 12 KVEC( 693) = -9 -3 8 9.1834 12 KVEC( 694) = -11 -5 -3 9.2132 12 KVEC( 695) = -11 -5 3 9.2132 12 KVEC( 696) = -11 -3 -5 9.2132 12 KVEC( 697) = -11 -3 5 9.2132 12 KVEC( 698) = -9 -7 -5 9.2132 12 KVEC( 699) = -9 -7 5 9.2132 12 KVEC( 700) = -9 -5 -7 9.2132 12 KVEC( 701) = -9 -5 7 9.2132 12 KVEC( 702) = -12 -3 -2 9.2724 12 KVEC( 703) = -12 -3 2 9.2724 12 KVEC( 704) = -12 -2 -3 9.2724 12 KVEC( 705) = -12 -2 3 9.2724 12 KVEC( 706) = -11 -6 0 9.2724 12 KVEC( 707) = -11 0 -6 9.2724 12 KVEC( 708) = -11 -6 -1 9.3019 12 KVEC( 709) = -11 -6 1 9.3019 12 KVEC( 710) = -11 -1 -6 9.3019 12 KVEC( 711) = -11 -1 6 9.3019 12 KVEC( 712) = -10 -7 -3 9.3019 12 KVEC( 713) = -10 -7 3 9.3019 12 KVEC( 714) = -10 -3 -7 9.3019 12 KVEC( 715) = -10 -3 7 9.3019 12 KVEC( 716) = -12 -4 0 9.3606 12 KVEC( 717) = -12 0 -4 9.3606 12 KVEC( 718) = -12 -4 -1 9.3898 12 KVEC( 719) = -12 -4 1 9.3898 12 KVEC( 720) = -12 -1 -4 9.3898 12 KVEC( 721) = -12 -1 4 9.3898 12 KVEC( 722) = -11 -6 -2 9.3898 12 KVEC( 723) = -11 -6 2 9.3898 12 KVEC( 724) = -11 -2 -6 9.3898 12 KVEC( 725) = -11 -2 6 9.3898 12 KVEC( 726) = -10 -6 -5 9.3898 12 KVEC( 727) = -10 -6 5 9.3898 12 KVEC( 728) = -10 -5 -6 9.3898 12 KVEC( 729) = -10 -5 6 9.3898 12 KVEC( 730) = -9 -8 -4 9.3898 12 KVEC( 731) = -9 -8 4 9.3898 12 KVEC( 732) = -9 -4 -8 9.3898 12 KVEC( 733) = -9 -4 8 9.3898 12 KVEC( 734) = -12 -3 -3 9.4189 12 KVEC( 735) = -12 -3 3 9.4189 12 KVEC( 736) = -11 -5 -4 9.4189 12 KVEC( 737) = -11 -5 4 9.4189 12 KVEC( 738) = -11 -4 -5 9.4189 12 KVEC( 739) = -11 -4 5 9.4189 12 KVEC( 740) = -9 -9 0 9.4189 12 KVEC( 741) = -8 -7 -7 9.4189 12 KVEC( 742) = -8 -7 7 9.4189 12 KVEC( 743) = -9 -9 -1 9.4480 12 KVEC( 744) = -9 -9 1 9.4480 12 KVEC( 745) = -12 -4 -2 9.4769 12 KVEC( 746) = -12 -4 2 9.4769 12 KVEC( 747) = -12 -2 -4 9.4769 12 KVEC( 748) = -12 -2 4 9.4769 12 KVEC( 749) = -10 -8 0 9.4769 12 KVEC( 750) = -10 0 -8 9.4769 12 KVEC( 751) = -8 -8 -6 9.4769 12 KVEC( 752) = -8 -8 6 9.4769 12 KVEC( 753) = -10 -8 -1 9.5058 12 KVEC( 754) = -10 -8 1 9.5058 12 KVEC( 755) = -10 -7 -4 9.5058 12 KVEC( 756) = -10 -7 4 9.5058 12 KVEC( 757) = -10 -4 -7 9.5058 12 KVEC( 758) = -10 -4 7 9.5058 12 KVEC( 759) = -10 -1 -8 9.5058 12 KVEC( 760) = -10 -1 8 9.5058 12 KVEC( 761) = -11 -6 -3 9.5345 12 KVEC( 762) = -11 -6 3 9.5345 12 KVEC( 763) = -11 -3 -6 9.5345 12 KVEC( 764) = -11 -3 6 9.5345 12 KVEC( 765) = -9 -9 -2 9.5345 12 KVEC( 766) = -9 -9 2 9.5345 12 KVEC( 767) = -9 -7 -6 9.5345 12 KVEC( 768) = -9 -7 6 9.5345 12 KVEC( 769) = -9 -6 -7 9.5345 12 KVEC( 770) = -9 -6 7 9.5345 12 KVEC( 771) = -10 -8 -2 9.5918 12 KVEC( 772) = -10 -8 2 9.5918 12 KVEC( 773) = -10 -2 -8 9.5918 12 KVEC( 774) = -10 -2 8 9.5918 12 KVEC( 775) = -13 0 0 9.6203 6 KVEC( 776) = -12 -5 0 9.6203 12 KVEC( 777) = -12 -4 -3 9.6203 12 KVEC( 778) = -12 -4 3 9.6203 12 KVEC( 779) = -12 -3 -4 9.6203 12 KVEC( 780) = -12 -3 4 9.6203 12 KVEC( 781) = -12 0 -5 9.6203 12 KVEC( 782) = -13 -1 0 9.6487 12 KVEC( 783) = -13 0 -1 9.6487 12 KVEC( 784) = -12 -5 -1 9.6487 12 KVEC( 785) = -12 -5 1 9.6487 12 KVEC( 786) = -12 -1 -5 9.6487 12 KVEC( 787) = -12 -1 5 9.6487 12 KVEC( 788) = -11 -7 0 9.6487 12 KVEC( 789) = -11 0 -7 9.6487 12 KVEC( 790) = -9 -8 -5 9.6487 12 KVEC( 791) = -9 -8 5 9.6487 12 KVEC( 792) = -9 -5 -8 9.6487 12 KVEC( 793) = -9 -5 8 9.6487 12 KVEC( 794) = -13 -1 -1 9.6770 12 KVEC( 795) = -13 -1 1 9.6770 12 KVEC( 796) = -11 -7 -1 9.6770 12 KVEC( 797) = -11 -7 1 9.6770 12 KVEC( 798) = -11 -5 -5 9.6770 12 KVEC( 799) = -11 -5 5 9.6770 12 KVEC( 800) = -11 -1 -7 9.6770 12 KVEC( 801) = -11 -1 7 9.6770 12 KVEC( 802) = -9 -9 -3 9.6770 12 KVEC( 803) = -9 -9 3 9.6770 12 KVEC( 804) = -10 -6 -6 9.7053 12 KVEC( 805) = -10 -6 6 9.7053 12 KVEC( 806) = -13 -2 0 9.7335 12 KVEC( 807) = -13 0 -2 9.7335 12 KVEC( 808) = -12 -5 -2 9.7335 12 KVEC( 809) = -12 -5 2 9.7335 12 KVEC( 810) = -12 -2 -5 9.7335 12 KVEC( 811) = -12 -2 5 9.7335 12 KVEC( 812) = -11 -6 -4 9.7335 12 KVEC( 813) = -11 -6 4 9.7335 12 KVEC( 814) = -11 -4 -6 9.7335 12 KVEC( 815) = -11 -4 6 9.7335 12 KVEC( 816) = -10 -8 -3 9.7335 12 KVEC( 817) = -10 -8 3 9.7335 12 KVEC( 818) = -10 -3 -8 9.7335 12 KVEC( 819) = -10 -3 8 9.7335 12 KVEC( 820) = -13 -2 -1 9.7616 12 KVEC( 821) = -13 -2 1 9.7616 12 KVEC( 822) = -13 -1 -2 9.7616 12 KVEC( 823) = -13 -1 2 9.7616 12 KVEC( 824) = -11 -7 -2 9.7616 12 KVEC( 825) = -11 -7 2 9.7616 12 KVEC( 826) = -11 -2 -7 9.7616 12 KVEC( 827) = -11 -2 7 9.7616 12 KVEC( 828) = -10 -7 -5 9.7616 12 KVEC( 829) = -10 -7 5 9.7616 12 KVEC( 830) = -10 -5 -7 9.7616 12 KVEC( 831) = -10 -5 7 9.7616 12 KVEC( 832) = -12 -4 -4 9.8175 12 KVEC( 833) = -12 -4 4 9.8175 12 KVEC( 834) = -13 -2 -2 9.8454 12 KVEC( 835) = -13 -2 2 9.8454 12 KVEC( 836) = -8 -8 -7 9.8454 12 KVEC( 837) = -8 -8 7 9.8454 12 KVEC( 838) = -13 -3 0 9.8731 12 KVEC( 839) = -13 0 -3 9.8731 12 KVEC( 840) = -12 -5 -3 9.8731 12 KVEC( 841) = -12 -5 3 9.8731 12 KVEC( 842) = -12 -3 -5 9.8731 12 KVEC( 843) = -12 -3 5 9.8731 12 KVEC( 844) = -9 -9 -4 9.8731 12 KVEC( 845) = -9 -9 4 9.8731 12 KVEC( 846) = -13 -3 -1 9.9008 12 KVEC( 847) = -13 -3 1 9.9008 12 KVEC( 848) = -13 -1 -3 9.9008 12 KVEC( 849) = -13 -1 3 9.9008 12 KVEC( 850) = -11 -7 -3 9.9008 12 KVEC( 851) = -11 -7 3 9.9008 12 KVEC( 852) = -11 -3 -7 9.9008 12 KVEC( 853) = -11 -3 7 9.9008 12 KVEC( 854) = -9 -7 -7 9.9008 12 KVEC( 855) = -9 -7 7 9.9008 12 KVEC( 856) = -12 -6 0 9.9284 12 KVEC( 857) = -12 0 -6 9.9284 12 KVEC( 858) = -10 -8 -4 9.9284 12 KVEC( 859) = -10 -8 4 9.9284 12 KVEC( 860) = -10 -4 -8 9.9284 12 KVEC( 861) = -10 -4 8 9.9284 12 KVEC( 862) = -12 -6 -1 9.9560 12 KVEC( 863) = -12 -6 1 9.9560 12 KVEC( 864) = -12 -1 -6 9.9560 12 KVEC( 865) = -12 -1 6 9.9560 12 KVEC( 866) = -10 -9 0 9.9560 12 KVEC( 867) = -10 0 -9 9.9560 12 KVEC( 868) = -9 -8 -6 9.9560 12 KVEC( 869) = -9 -8 6 9.9560 12 KVEC( 870) = -9 -6 -8 9.9560 12 KVEC( 871) = -9 -6 8 9.9560 12 KVEC( 872) = -13 -3 -2 9.9834 12 KVEC( 873) = -13 -3 2 9.9834 12 KVEC( 874) = -13 -2 -3 9.9834 12 KVEC( 875) = -13 -2 3 9.9834 12 KVEC( 876) = -11 -6 -5 9.9834 12 KVEC( 877) = -11 -6 5 9.9834 12 KVEC( 878) = -11 -5 -6 9.9834 12 KVEC( 879) = -11 -5 6 9.9834 12 KVEC( 880) = -10 -9 -1 9.9834 12 KVEC( 881) = -10 -9 1 9.9834 12 KVEC( 882) = -10 -1 -9 9.9834 12 KVEC( 883) = -10 -1 9 9.9834 12 KVEC( 884) = -12 -6 -2 10.0381 12 KVEC( 885) = -12 -6 2 10.0381 12 KVEC( 886) = -12 -2 -6 10.0381 12 KVEC( 887) = -12 -2 6 10.0381 12 KVEC( 888) = -13 -4 0 10.0654 12 KVEC( 889) = -13 0 -4 10.0654 12 KVEC( 890) = -12 -5 -4 10.0654 12 KVEC( 891) = -12 -5 4 10.0654 12 KVEC( 892) = -12 -4 -5 10.0654 12 KVEC( 893) = -12 -4 5 10.0654 12 KVEC( 894) = -11 -8 0 10.0654 12 KVEC( 895) = -11 0 -8 10.0654 12 KVEC( 896) = -10 -9 -2 10.0654 12 KVEC( 897) = -10 -9 2 10.0654 12 KVEC( 898) = -10 -7 -6 10.0654 12 KVEC( 899) = -10 -7 6 10.0654 12 KVEC( 900) = -10 -6 -7 10.0654 12 KVEC( 901) = -10 -6 7 10.0654 12 KVEC( 902) = -10 -2 -9 10.0654 12 KVEC( 903) = -10 -2 9 10.0654 12 KVEC( 904) = -13 -4 -1 10.0926 12 KVEC( 905) = -13 -4 1 10.0926 12 KVEC( 906) = -13 -1 -4 10.0926 12 KVEC( 907) = -13 -1 4 10.0926 12 KVEC( 908) = -11 -8 -1 10.0926 12 KVEC( 909) = -11 -8 1 10.0926 12 KVEC( 910) = -11 -7 -4 10.0926 12 KVEC( 911) = -11 -7 4 10.0926 12 KVEC( 912) = -11 -4 -7 10.0926 12 KVEC( 913) = -11 -4 7 10.0926 12 KVEC( 914) = -11 -1 -8 10.0926 12 KVEC( 915) = -11 -1 8 10.0926 12 KVEC( 916) = -13 -3 -3 10.1196 12 KVEC( 917) = -13 -3 3 10.1196 12 KVEC( 918) = -9 -9 -5 10.1196 12 KVEC( 919) = -9 -9 5 10.1196 12 KVEC( 920) = -13 -4 -2 10.1736 12 KVEC( 921) = -13 -4 2 10.1736 12 KVEC( 922) = -13 -2 -4 10.1736 12 KVEC( 923) = -13 -2 4 10.1736 12 KVEC( 924) = -12 -6 -3 10.1736 12 KVEC( 925) = -12 -6 3 10.1736 12 KVEC( 926) = -12 -3 -6 10.1736 12 KVEC( 927) = -12 -3 6 10.1736 12 KVEC( 928) = -11 -8 -2 10.1736 12 KVEC( 929) = -11 -8 2 10.1736 12 KVEC( 930) = -11 -2 -8 10.1736 12 KVEC( 931) = -11 -2 8 10.1736 12 KVEC( 932) = -10 -8 -5 10.1736 12 KVEC( 933) = -10 -8 5 10.1736 12 KVEC( 934) = -10 -5 -8 10.1736 12 KVEC( 935) = -10 -5 8 10.1736 12 KVEC( 936) = -10 -9 -3 10.2005 12 KVEC( 937) = -10 -9 3 10.2005 12 KVEC( 938) = -10 -3 -9 10.2005 12 KVEC( 939) = -10 -3 9 10.2005 12 KVEC( 940) = -8 -8 -8 10.2540 4 KVEC( 941) = -8 -8 8 10.2540 4 KVEC( 942) = -12 -7 0 10.2807 12 KVEC( 943) = -12 0 -7 10.2807 12 KVEC( 944) = -11 -6 -6 10.2807 12 KVEC( 945) = -11 -6 6 10.2807 12 KVEC( 946) = -13 -5 0 10.3073 12 KVEC( 947) = -13 -4 -3 10.3073 12 KVEC( 948) = -13 -4 3 10.3073 12 KVEC( 949) = -13 -3 -4 10.3073 12 KVEC( 950) = -13 -3 4 10.3073 12 KVEC( 951) = -13 0 -5 10.3073 12 KVEC( 952) = -12 -7 -1 10.3073 12 KVEC( 953) = -12 -7 1 10.3073 12 KVEC( 954) = -12 -5 -5 10.3073 12 KVEC( 955) = -12 -5 5 10.3073 12 KVEC( 956) = -12 -1 -7 10.3073 12 KVEC( 957) = -12 -1 7 10.3073 12 KVEC( 958) = -11 -8 -3 10.3073 12 KVEC( 959) = -11 -8 3 10.3073 12 KVEC( 960) = -11 -3 -8 10.3073 12 KVEC( 961) = -11 -3 8 10.3073 12 KVEC( 962) = -9 -8 -7 10.3073 12 KVEC( 963) = -9 -8 7 10.3073 12 KVEC( 964) = -9 -7 -8 10.3073 12 KVEC( 965) = -9 -7 8 10.3073 12 KVEC( 966) = -13 -5 -1 10.3338 12 KVEC( 967) = -13 -5 1 10.3338 12 KVEC( 968) = -13 -1 -5 10.3338 12 KVEC( 969) = -13 -1 5 10.3338 12 KVEC( 970) = -11 -7 -5 10.3338 12 KVEC( 971) = -11 -7 5 10.3338 12 KVEC( 972) = -11 -5 -7 10.3338 12 KVEC( 973) = -11 -5 7 10.3338 12 KVEC( 974) = -14 0 0 10.3603 6 KVEC( 975) = -12 -6 -4 10.3603 12 KVEC( 976) = -12 -6 4 10.3603 12 KVEC( 977) = -12 -4 -6 10.3603 12 KVEC( 978) = -12 -4 6 10.3603 12 KVEC( 979) = -14 -1 0 10.3867 12 KVEC( 980) = -14 0 -1 10.3867 12 KVEC( 981) = -12 -7 -2 10.3867 12 KVEC( 982) = -12 -7 2 10.3867 12 KVEC( 983) = -12 -2 -7 10.3867 12 KVEC( 984) = -12 -2 7 10.3867 12 KVEC( 985) = -10 -9 -4 10.3867 12 KVEC( 986) = -10 -9 4 10.3867 12 KVEC( 987) = -10 -4 -9 10.3867 12 KVEC( 988) = -10 -4 9 10.3867 12 KVEC( 989) = -14 -1 -1 10.4130 12 KVEC( 990) = -14 -1 1 10.4130 12 KVEC( 991) = -13 -5 -2 10.4130 12 KVEC( 992) = -13 -5 2 10.4130 12 KVEC( 993) = -13 -2 -5 10.4130 12 KVEC( 994) = -13 -2 5 10.4130 12 KVEC( 995) = -10 -7 -7 10.4130 12 KVEC( 996) = -10 -7 7 10.4130 12 KVEC( 997) = -9 -9 -6 10.4130 12 KVEC( 998) = -9 -9 6 10.4130 12 KVEC( 999) = -14 -2 0 10.4655 12 KVEC( 1000) = -14 0 -2 10.4655 12 KVEC( 1001) = -10 -10 0 10.4655 12 KVEC( 1002) = -10 -8 -6 10.4655 12 KVEC( 1003) = -10 -8 6 10.4655 12 KVEC( 1004) = -10 -6 -8 10.4655 12 KVEC( 1005) = -10 -6 8 10.4655 12 KVEC( 1006) = -14 -2 -1 10.4916 12 KVEC( 1007) = -14 -2 1 10.4916 12 KVEC( 1008) = -14 -1 -2 10.4916 12 KVEC( 1009) = -14 -1 2 10.4916 12 KVEC( 1010) = -13 -4 -4 10.4916 12 KVEC( 1011) = -13 -4 4 10.4916 12 KVEC( 1012) = -11 -8 -4 10.4916 12 KVEC( 1013) = -11 -8 4 10.4916 12 KVEC( 1014) = -11 -4 -8 10.4916 12 KVEC( 1015) = -11 -4 8 10.4916 12 KVEC( 1016) = -10 -10 -1 10.4916 12 KVEC( 1017) = -10 -10 1 10.4916 12 KVEC( 1018) = -12 -7 -3 10.5177 12 KVEC( 1019) = -12 -7 3 10.5177 12 KVEC( 1020) = -12 -3 -7 10.5177 12 KVEC( 1021) = -12 -3 7 10.5177 12 KVEC( 1022) = -11 -9 0 10.5177 12 KVEC( 1023) = -11 0 -9 10.5177 12 KVEC( 1024) = -13 -5 -3 10.5437 12 KVEC( 1025) = -13 -5 3 10.5437 12 KVEC( 1026) = -13 -3 -5 10.5437 12 KVEC( 1027) = -13 -3 5 10.5437 12 KVEC( 1028) = -11 -9 -1 10.5437 12 KVEC( 1029) = -11 -9 1 10.5437 12 KVEC( 1030) = -11 -1 -9 10.5437 12 KVEC( 1031) = -11 -1 9 10.5437 12 KVEC( 1032) = -14 -2 -2 10.5696 12 KVEC( 1033) = -14 -2 2 10.5696 12 KVEC( 1034) = -10 -10 -2 10.5696 12 KVEC( 1035) = -10 -10 2 10.5696 12 KVEC( 1036) = -14 -3 0 10.5955 12 KVEC( 1037) = -14 0 -3 10.5955 12 KVEC( 1038) = -13 -6 0 10.5955 12 KVEC( 1039) = -13 0 -6 10.5955 12 KVEC( 1040) = -12 -6 -5 10.5955 12 KVEC( 1041) = -12 -6 5 10.5955 12 KVEC( 1042) = -12 -5 -6 10.5955 12 KVEC( 1043) = -12 -5 6 10.5955 12 KVEC( 1044) = -14 -3 -1 10.6213 12 KVEC( 1045) = -14 -3 1 10.6213 12 KVEC( 1046) = -14 -1 -3 10.6213 12 KVEC( 1047) = -14 -1 3 10.6213 12 KVEC( 1048) = -13 -6 -1 10.6213 12 KVEC( 1049) = -13 -6 1 10.6213 12 KVEC( 1050) = -13 -1 -6 10.6213 12 KVEC( 1051) = -13 -1 6 10.6213 12 KVEC( 1052) = -11 -9 -2 10.6213 12 KVEC( 1053) = -11 -9 2 10.6213 12 KVEC( 1054) = -11 -7 -6 10.6213 12 KVEC( 1055) = -11 -7 6 10.6213 12 KVEC( 1056) = -11 -6 -7 10.6213 12 KVEC( 1057) = -11 -6 7 10.6213 12 KVEC( 1058) = -11 -2 -9 10.6213 12 KVEC( 1059) = -11 -2 9 10.6213 12 KVEC( 1060) = -10 -9 -5 10.6213 12 KVEC( 1061) = -10 -9 5 10.6213 12 KVEC( 1062) = -10 -5 -9 10.6213 12 KVEC( 1063) = -10 -5 9 10.6213 12 KVEC( 1064) = -12 -8 0 10.6727 12 KVEC( 1065) = -12 0 -8 10.6727 12 KVEC( 1066) = -14 -3 -2 10.6984 12 KVEC( 1067) = -14 -3 2 10.6984 12 KVEC( 1068) = -14 -2 -3 10.6984 12 KVEC( 1069) = -14 -2 3 10.6984 12 KVEC( 1070) = -13 -6 -2 10.6984 12 KVEC( 1071) = -13 -6 2 10.6984 12 KVEC( 1072) = -13 -2 -6 10.6984 12 KVEC( 1073) = -13 -2 6 10.6984 12 KVEC( 1074) = -12 -8 -1 10.6984 12 KVEC( 1075) = -12 -8 1 10.6984 12 KVEC( 1076) = -12 -7 -4 10.6984 12 KVEC( 1077) = -12 -7 4 10.6984 12 KVEC( 1078) = -12 -4 -7 10.6984 12 KVEC( 1079) = -12 -4 7 10.6984 12 KVEC( 1080) = -12 -1 -8 10.6984 12 KVEC( 1081) = -12 -1 8 10.6984 12 KVEC( 1082) = -10 -10 -3 10.6984 12 KVEC( 1083) = -10 -10 3 10.6984 12 KVEC( 1084) = -9 -8 -8 10.6984 12 KVEC( 1085) = -9 -8 8 10.6984 12 KVEC( 1086) = -13 -5 -4 10.7239 12 KVEC( 1087) = -13 -5 4 10.7239 12 KVEC( 1088) = -13 -4 -5 10.7239 12 KVEC( 1089) = -13 -4 5 10.7239 12 KVEC( 1090) = -11 -8 -5 10.7239 12 KVEC( 1091) = -11 -8 5 10.7239 12 KVEC( 1092) = -11 -5 -8 10.7239 12 KVEC( 1093) = -11 -5 8 10.7239 12 KVEC( 1094) = -11 -9 -3 10.7494 12 KVEC( 1095) = -11 -9 3 10.7494 12 KVEC( 1096) = -11 -3 -9 10.7494 12 KVEC( 1097) = -11 -3 9 10.7494 12 KVEC( 1098) = -9 -9 -7 10.7494 12 KVEC( 1099) = -9 -9 7 10.7494 12 KVEC( 1100) = -14 -4 0 10.7749 12 KVEC( 1101) = -14 0 -4 10.7749 12 KVEC( 1102) = -12 -8 -2 10.7749 12 KVEC( 1103) = -12 -8 2 10.7749 12 KVEC( 1104) = -12 -2 -8 10.7749 12 KVEC( 1105) = -12 -2 8 10.7749 12 KVEC( 1106) = -14 -4 -1 10.8003 12 KVEC( 1107) = -14 -4 1 10.8003 12 KVEC( 1108) = -14 -1 -4 10.8003 12 KVEC( 1109) = -14 -1 4 10.8003 12 KVEC( 1110) = -10 -8 -7 10.8003 12 KVEC( 1111) = -10 -8 7 10.8003 12 KVEC( 1112) = -10 -7 -8 10.8003 12 KVEC( 1113) = -10 -7 8 10.8003 12 KVEC( 1114) = -14 -3 -3 10.8256 12 KVEC( 1115) = -14 -3 3 10.8256 12 KVEC( 1116) = -13 -6 -3 10.8256 12 KVEC( 1117) = -13 -6 3 10.8256 12 KVEC( 1118) = -13 -3 -6 10.8256 12 KVEC( 1119) = -13 -3 6 10.8256 12 KVEC( 1120) = -14 -4 -2 10.8761 12 KVEC( 1121) = -14 -4 2 10.8761 12 KVEC( 1122) = -14 -2 -4 10.8761 12 KVEC( 1123) = -14 -2 4 10.8761 12 KVEC( 1124) = -12 -6 -6 10.8761 12 KVEC( 1125) = -12 -6 6 10.8761 12 KVEC( 1126) = -10 -10 -4 10.8761 12 KVEC( 1127) = -10 -10 4 10.8761 12 KVEC( 1128) = -12 -8 -3 10.9012 12 KVEC( 1129) = -12 -8 3 10.9012 12 KVEC( 1130) = -12 -3 -8 10.9012 12 KVEC( 1131) = -12 -3 8 10.9012 12 KVEC( 1132) = -10 -9 -6 10.9012 12 KVEC( 1133) = -10 -9 6 10.9012 12 KVEC( 1134) = -10 -6 -9 10.9012 12 KVEC( 1135) = -10 -6 9 10.9012 12 KVEC( 1136) = -13 -7 0 10.9263 12 KVEC( 1137) = -13 0 -7 10.9263 12 KVEC( 1138) = -12 -7 -5 10.9263 12 KVEC( 1139) = -12 -7 5 10.9263 12 KVEC( 1140) = -12 -5 -7 10.9263 12 KVEC( 1141) = -12 -5 7 10.9263 12 KVEC( 1142) = -11 -9 -4 10.9263 12 KVEC( 1143) = -11 -9 4 10.9263 12 KVEC( 1144) = -11 -4 -9 10.9263 12 KVEC( 1145) = -11 -4 9 10.9263 12 KVEC( 1146) = -13 -7 -1 10.9513 12 KVEC( 1147) = -13 -7 1 10.9513 12 KVEC( 1148) = -13 -5 -5 10.9513 12 KVEC( 1149) = -13 -5 5 10.9513 12 KVEC( 1150) = -13 -1 -7 10.9513 12 KVEC( 1151) = -13 -1 7 10.9513 12 KVEC( 1152) = -11 -7 -7 10.9513 12 KVEC( 1153) = -11 -7 7 10.9513 12 KVEC( 1154) = -14 -5 0 11.0012 12 KVEC( 1155) = -14 -4 -3 11.0012 12 KVEC( 1156) = -14 -4 3 11.0012 12 KVEC( 1157) = -14 -3 -4 11.0012 12 KVEC( 1158) = -14 -3 4 11.0012 12 KVEC( 1159) = -14 0 -5 11.0012 12 KVEC( 1160) = -13 -6 -4 11.0012 12 KVEC( 1161) = -13 -6 4 11.0012 12 KVEC( 1162) = -13 -4 -6 11.0012 12 KVEC( 1163) = -13 -4 6 11.0012 12 KVEC( 1164) = -11 -10 0 11.0012 12 KVEC( 1165) = -11 -8 -6 11.0012 12 KVEC( 1166) = -11 -8 6 11.0012 12 KVEC( 1167) = -11 -6 -8 11.0012 12 KVEC( 1168) = -11 -6 8 11.0012 12 KVEC( 1169) = -11 0 -10 11.0012 12 KVEC( 1170) = -14 -5 -1 11.0261 12 KVEC( 1171) = -14 -5 1 11.0261 12 KVEC( 1172) = -14 -1 -5 11.0261 12 KVEC( 1173) = -14 -1 5 11.0261 12 KVEC( 1174) = -13 -7 -2 11.0261 12 KVEC( 1175) = -13 -7 2 11.0261 12 KVEC( 1176) = -13 -2 -7 11.0261 12 KVEC( 1177) = -13 -2 7 11.0261 12 KVEC( 1178) = -11 -10 -1 11.0261 12 KVEC( 1179) = -11 -10 1 11.0261 12 KVEC( 1180) = -11 -1 -10 11.0261 12 KVEC( 1181) = -11 -1 10 11.0261 12 KVEC( 1182) = -12 -8 -4 11.0756 12 KVEC( 1183) = -12 -8 4 11.0756 12 KVEC( 1184) = -12 -4 -8 11.0756 12 KVEC( 1185) = -12 -4 8 11.0756 12 KVEC( 1186) = -15 0 0 11.1003 6 KVEC( 1187) = -14 -5 -2 11.1003 12 KVEC( 1188) = -14 -5 2 11.1003 12 KVEC( 1189) = -14 -2 -5 11.1003 12 KVEC( 1190) = -14 -2 5 11.1003 12 KVEC( 1191) = -12 -9 0 11.1003 12 KVEC( 1192) = -12 0 -9 11.1003 12 KVEC( 1193) = -11 -10 -2 11.1003 12 KVEC( 1194) = -11 -10 2 11.1003 12 KVEC( 1195) = -11 -2 -10 11.1003 12 KVEC( 1196) = -11 -2 10 11.1003 12 KVEC( 1197) = -10 -10 -5 11.1003 12 KVEC( 1198) = -10 -10 5 11.1003 12 KVEC( 1199) = -15 -1 0 11.1250 12 KVEC( 1200) = -15 0 -1 11.1250 12 KVEC( 1201) = -12 -9 -1 11.1250 12 KVEC( 1202) = -12 -9 1 11.1250 12 KVEC( 1203) = -12 -1 -9 11.1250 12 KVEC( 1204) = -12 -1 9 11.1250 12 KVEC( 1205) = -9 -9 -8 11.1250 12 KVEC( 1206) = -9 -9 8 11.1250 12 KVEC( 1207) = -15 -1 -1 11.1496 12 KVEC( 1208) = -15 -1 1 11.1496 12 KVEC( 1209) = -13 -7 -3 11.1496 12 KVEC( 1210) = -13 -7 3 11.1496 12 KVEC( 1211) = -13 -3 -7 11.1496 12 KVEC( 1212) = -13 -3 7 11.1496 12 KVEC( 1213) = -11 -9 -5 11.1496 12 KVEC( 1214) = -11 -9 5 11.1496 12 KVEC( 1215) = -11 -5 -9 11.1496 12 KVEC( 1216) = -11 -5 9 11.1496 12 KVEC( 1217) = -14 -4 -4 11.1741 12 KVEC( 1218) = -14 -4 4 11.1741 12 KVEC( 1219) = -10 -8 -8 11.1741 12 KVEC( 1220) = -10 -8 8 11.1741 12 KVEC( 1221) = -15 -2 0 11.1986 12 KVEC( 1222) = -15 0 -2 11.1986 12 KVEC( 1223) = -12 -9 -2 11.1986 12 KVEC( 1224) = -12 -9 2 11.1986 12 KVEC( 1225) = -12 -7 -6 11.1986 12 KVEC( 1226) = -12 -7 6 11.1986 12 KVEC( 1227) = -12 -6 -7 11.1986 12 KVEC( 1228) = -12 -6 7 11.1986 12 KVEC( 1229) = -12 -2 -9 11.1986 12 KVEC( 1230) = -12 -2 9 11.1986 12 KVEC( 1231) = -15 -2 -1 11.2230 12 KVEC( 1232) = -15 -2 1 11.2230 12 KVEC( 1233) = -15 -1 -2 11.2230 12 KVEC( 1234) = -15 -1 2 11.2230 12 KVEC( 1235) = -14 -5 -3 11.2230 12 KVEC( 1236) = -14 -5 3 11.2230 12 KVEC( 1237) = -14 -3 -5 11.2230 12 KVEC( 1238) = -14 -3 5 11.2230 12 KVEC( 1239) = -13 -6 -5 11.2230 12 KVEC( 1240) = -13 -6 5 11.2230 12 KVEC( 1241) = -13 -5 -6 11.2230 12 KVEC( 1242) = -13 -5 6 11.2230 12 KVEC( 1243) = -11 -10 -3 11.2230 12 KVEC( 1244) = -11 -10 3 11.2230 12 KVEC( 1245) = -11 -3 -10 11.2230 12 KVEC( 1246) = -11 -3 10 11.2230 12 KVEC( 1247) = -10 -9 -7 11.2230 12 KVEC( 1248) = -10 -9 7 11.2230 12 KVEC( 1249) = -10 -7 -9 11.2230 12 KVEC( 1250) = -10 -7 9 11.2230 12 KVEC( 1251) = -14 -6 0 11.2717 12 KVEC( 1252) = -14 0 -6 11.2717 12 KVEC( 1253) = -15 -2 -2 11.2959 12 KVEC( 1254) = -15 -2 2 11.2959 12 KVEC( 1255) = -14 -6 -1 11.2959 12 KVEC( 1256) = -14 -6 1 11.2959 12 KVEC( 1257) = -14 -1 -6 11.2959 12 KVEC( 1258) = -14 -1 6 11.2959 12 KVEC( 1259) = -13 -8 0 11.2959 12 KVEC( 1260) = -13 0 -8 11.2959 12 KVEC( 1261) = -12 -8 -5 11.2959 12 KVEC( 1262) = -12 -8 5 11.2959 12 KVEC( 1263) = -12 -5 -8 11.2959 12 KVEC( 1264) = -12 -5 8 11.2959 12 KVEC( 1265) = -15 -3 0 11.3202 12 KVEC( 1266) = -15 0 -3 11.3202 12 KVEC( 1267) = -13 -8 -1 11.3202 12 KVEC( 1268) = -13 -8 1 11.3202 12 KVEC( 1269) = -13 -7 -4 11.3202 12 KVEC( 1270) = -13 -7 4 11.3202 12 KVEC( 1271) = -13 -4 -7 11.3202 12 KVEC( 1272) = -13 -4 7 11.3202 12 KVEC( 1273) = -13 -1 -8 11.3202 12 KVEC( 1274) = -13 -1 8 11.3202 12 KVEC( 1275) = -12 -9 -3 11.3202 12 KVEC( 1276) = -12 -9 3 11.3202 12 KVEC( 1277) = -12 -3 -9 11.3202 12 KVEC( 1278) = -12 -3 9 11.3202 12 KVEC( 1279) = -11 -8 -7 11.3202 12 KVEC( 1280) = -11 -8 7 11.3202 12 KVEC( 1281) = -11 -7 -8 11.3202 12 KVEC( 1282) = -11 -7 8 11.3202 12 KVEC( 1283) = -15 -3 -1 11.3443 12 KVEC( 1284) = -15 -3 1 11.3443 12 KVEC( 1285) = -15 -1 -3 11.3443 12 KVEC( 1286) = -15 -1 3 11.3443 12 KVEC( 1287) = -14 -6 -2 11.3684 12 KVEC( 1288) = -14 -6 2 11.3684 12 KVEC( 1289) = -14 -2 -6 11.3684 12 KVEC( 1290) = -14 -2 6 11.3684 12 KVEC( 1291) = -10 -10 -6 11.3684 12 KVEC( 1292) = -10 -10 6 11.3684 12 KVEC( 1293) = -14 -5 -4 11.3925 12 KVEC( 1294) = -14 -5 4 11.3925 12 KVEC( 1295) = -14 -4 -5 11.3925 12 KVEC( 1296) = -14 -4 5 11.3925 12 KVEC( 1297) = -13 -8 -2 11.3925 12 KVEC( 1298) = -13 -8 2 11.3925 12 KVEC( 1299) = -13 -2 -8 11.3925 12 KVEC( 1300) = -13 -2 8 11.3925 12 KVEC( 1301) = -11 -10 -4 11.3925 12 KVEC( 1302) = -11 -10 4 11.3925 12 KVEC( 1303) = -11 -4 -10 11.3925 12 KVEC( 1304) = -11 -4 10 11.3925 12 KVEC( 1305) = -15 -3 -2 11.4165 12 KVEC( 1306) = -15 -3 2 11.4165 12 KVEC( 1307) = -15 -2 -3 11.4165 12 KVEC( 1308) = -15 -2 3 11.4165 12 KVEC( 1309) = -11 -9 -6 11.4165 12 KVEC( 1310) = -11 -9 6 11.4165 12 KVEC( 1311) = -11 -6 -9 11.4165 12 KVEC( 1312) = -11 -6 9 11.4165 12 KVEC( 1313) = -15 -4 0 11.4882 12 KVEC( 1314) = -15 0 -4 11.4882 12 KVEC( 1315) = -14 -6 -3 11.4882 12 KVEC( 1316) = -14 -6 3 11.4882 12 KVEC( 1317) = -14 -3 -6 11.4882 12 KVEC( 1318) = -14 -3 6 11.4882 12 KVEC( 1319) = -13 -6 -6 11.4882 12 KVEC( 1320) = -13 -6 6 11.4882 12 KVEC( 1321) = -12 -9 -4 11.4882 12 KVEC( 1322) = -12 -9 4 11.4882 12 KVEC( 1323) = -12 -4 -9 11.4882 12 KVEC( 1324) = -12 -4 9 11.4882 12 KVEC( 1325) = -15 -4 -1 11.5120 12 KVEC( 1326) = -15 -4 1 11.5120 12 KVEC( 1327) = -15 -1 -4 11.5120 12 KVEC( 1328) = -15 -1 4 11.5120 12 KVEC( 1329) = -13 -8 -3 11.5120 12 KVEC( 1330) = -13 -8 3 11.5120 12 KVEC( 1331) = -13 -3 -8 11.5120 12 KVEC( 1332) = -13 -3 8 11.5120 12 KVEC( 1333) = -12 -7 -7 11.5120 12 KVEC( 1334) = -12 -7 7 11.5120 12 KVEC( 1335) = -11 -11 0 11.5120 12 KVEC( 1336) = -15 -3 -3 11.5358 12 KVEC( 1337) = -15 -3 3 11.5358 12 KVEC( 1338) = -13 -7 -5 11.5358 12 KVEC( 1339) = -13 -7 5 11.5358 12 KVEC( 1340) = -13 -5 -7 11.5358 12 KVEC( 1341) = -13 -5 7 11.5358 12 KVEC( 1342) = -11 -11 -1 11.5358 12 KVEC( 1343) = -11 -11 1 11.5358 12 KVEC( 1344) = -9 -9 -9 11.5358 4 KVEC( 1345) = -9 -9 9 11.5358 4 KVEC( 1346) = -12 -10 0 11.5595 12 KVEC( 1347) = -12 -8 -6 11.5595 12 KVEC( 1348) = -12 -8 6 11.5595 12 KVEC( 1349) = -12 -6 -8 11.5595 12 KVEC( 1350) = -12 -6 8 11.5595 12 KVEC( 1351) = -12 0 -10 11.5595 12 KVEC( 1352) = -15 -4 -2 11.5832 12 KVEC( 1353) = -15 -4 2 11.5832 12 KVEC( 1354) = -15 -2 -4 11.5832 12 KVEC( 1355) = -15 -2 4 11.5832 12 KVEC( 1356) = -14 -7 0 11.5832 12 KVEC( 1357) = -14 0 -7 11.5832 12 KVEC( 1358) = -12 -10 -1 11.5832 12 KVEC( 1359) = -12 -10 1 11.5832 12 KVEC( 1360) = -12 -1 -10 11.5832 12 KVEC( 1361) = -12 -1 10 11.5832 12 KVEC( 1362) = -10 -9 -8 11.5832 12 KVEC( 1363) = -10 -9 8 11.5832 12 KVEC( 1364) = -10 -8 -9 11.5832 12 KVEC( 1365) = -10 -8 9 11.5832 12 KVEC( 1366) = -14 -7 -1 11.6068 12 KVEC( 1367) = -14 -7 1 11.6068 12 KVEC( 1368) = -14 -5 -5 11.6068 12 KVEC( 1369) = -14 -5 5 11.6068 12 KVEC( 1370) = -14 -1 -7 11.6068 12 KVEC( 1371) = -14 -1 7 11.6068 12 KVEC( 1372) = -11 -11 -2 11.6068 12 KVEC( 1373) = -11 -11 2 11.6068 12 KVEC( 1374) = -11 -10 -5 11.6068 12 KVEC( 1375) = -11 -10 5 11.6068 12 KVEC( 1376) = -11 -5 -10 11.6068 12 KVEC( 1377) = -11 -5 10 11.6068 12 KVEC( 1378) = -14 -6 -4 11.6539 12 KVEC( 1379) = -14 -6 4 11.6539 12 KVEC( 1380) = -14 -4 -6 11.6539 12 KVEC( 1381) = -14 -4 6 11.6539 12 KVEC( 1382) = -12 -10 -2 11.6539 12 KVEC( 1383) = -12 -10 2 11.6539 12 KVEC( 1384) = -12 -2 -10 11.6539 12 KVEC( 1385) = -12 -2 10 11.6539 12 KVEC( 1386) = -14 -7 -2 11.6773 12 KVEC( 1387) = -14 -7 2 11.6773 12 KVEC( 1388) = -14 -2 -7 11.6773 12 KVEC( 1389) = -14 -2 7 11.6773 12 KVEC( 1390) = -13 -8 -4 11.6773 12 KVEC( 1391) = -13 -8 4 11.6773 12 KVEC( 1392) = -13 -4 -8 11.6773 12 KVEC( 1393) = -13 -4 8 11.6773 12 KVEC( 1394) = -11 -8 -8 11.6773 12 KVEC( 1395) = -11 -8 8 11.6773 12 KVEC( 1396) = -10 -10 -7 11.6773 12 KVEC( 1397) = -10 -10 7 11.6773 12 KVEC( 1398) = -15 -5 0 11.7008 12 KVEC( 1399) = -15 -4 -3 11.7008 12 KVEC( 1400) = -15 -4 3 11.7008 12 KVEC( 1401) = -15 -3 -4 11.7008 12 KVEC( 1402) = -15 -3 4 11.7008 12 KVEC( 1403) = -15 0 -5 11.7008 12 KVEC( 1404) = -13 -9 0 11.7008 12 KVEC( 1405) = -13 0 -9 11.7008 12 KVEC( 1406) = -12 -9 -5 11.7008 12 KVEC( 1407) = -12 -9 5 11.7008 12 KVEC( 1408) = -12 -5 -9 11.7008 12 KVEC( 1409) = -12 -5 9 11.7008 12 KVEC( 1410) = -15 -5 -1 11.7242 12 KVEC( 1411) = -15 -5 1 11.7242 12 KVEC( 1412) = -15 -1 -5 11.7242 12 KVEC( 1413) = -15 -1 5 11.7242 12 KVEC( 1414) = -13 -9 -1 11.7242 12 KVEC( 1415) = -13 -9 1 11.7242 12 KVEC( 1416) = -13 -1 -9 11.7242 12 KVEC( 1417) = -13 -1 9 11.7242 12 KVEC( 1418) = -11 -11 -3 11.7242 12 KVEC( 1419) = -11 -11 3 11.7242 12 KVEC( 1420) = -11 -9 -7 11.7242 12 KVEC( 1421) = -11 -9 7 11.7242 12 KVEC( 1422) = -11 -7 -9 11.7242 12 KVEC( 1423) = -11 -7 9 11.7242 12 KVEC( 1424) = -12 -10 -3 11.7708 12 KVEC( 1425) = -12 -10 3 11.7708 12 KVEC( 1426) = -12 -3 -10 11.7708 12 KVEC( 1427) = -12 -3 10 11.7708 12 KVEC( 1428) = -15 -5 -2 11.7940 12 KVEC( 1429) = -15 -5 2 11.7940 12 KVEC( 1430) = -15 -2 -5 11.7940 12 KVEC( 1431) = -15 -2 5 11.7940 12 KVEC( 1432) = -14 -7 -3 11.7940 12 KVEC( 1433) = -14 -7 3 11.7940 12 KVEC( 1434) = -14 -3 -7 11.7940 12 KVEC( 1435) = -14 -3 7 11.7940 12 KVEC( 1436) = -13 -9 -2 11.7940 12 KVEC( 1437) = -13 -9 2 11.7940 12 KVEC( 1438) = -13 -7 -6 11.7940 12 KVEC( 1439) = -13 -7 6 11.7940 12 KVEC( 1440) = -13 -6 -7 11.7940 12 KVEC( 1441) = -13 -6 7 11.7940 12 KVEC( 1442) = -13 -2 -9 11.7940 12 KVEC( 1443) = -13 -2 9 11.7940 12 KVEC( 1444) = -16 0 0 11.8403 6 KVEC( 1445) = -16 -1 0 11.8635 12 KVEC( 1446) = -16 0 -1 11.8635 12 KVEC( 1447) = -15 -4 -4 11.8635 12 KVEC( 1448) = -15 -4 4 11.8635 12 KVEC( 1449) = -14 -6 -5 11.8635 12 KVEC( 1450) = -14 -6 5 11.8635 12 KVEC( 1451) = -14 -5 -6 11.8635 12 KVEC( 1452) = -14 -5 6 11.8635 12 KVEC( 1453) = -12 -8 -7 11.8635 12 KVEC( 1454) = -12 -8 7 11.8635 12 KVEC( 1455) = -12 -7 -8 11.8635 12 KVEC( 1456) = -12 -7 8 11.8635 12 KVEC( 1457) = -11 -10 -6 11.8635 12 KVEC( 1458) = -11 -10 6 11.8635 12 KVEC( 1459) = -11 -6 -10 11.8635 12 KVEC( 1460) = -11 -6 10 11.8635 12 KVEC( 1461) = -16 -1 -1 11.8865 12 KVEC( 1462) = -16 -1 1 11.8865 12 KVEC( 1463) = -13 -8 -5 11.8865 12 KVEC( 1464) = -13 -8 5 11.8865 12 KVEC( 1465) = -13 -5 -8 11.8865 12 KVEC( 1466) = -13 -5 8 11.8865 12 KVEC( 1467) = -11 -11 -4 11.8865 12 KVEC( 1468) = -11 -11 4 11.8865 12 KVEC( 1469) = -15 -5 -3 11.9095 12 KVEC( 1470) = -15 -5 3 11.9095 12 KVEC( 1471) = -15 -3 -5 11.9095 12 KVEC( 1472) = -15 -3 5 11.9095 12 KVEC( 1473) = -13 -9 -3 11.9095 12 KVEC( 1474) = -13 -9 3 11.9095 12 KVEC( 1475) = -13 -3 -9 11.9095 12 KVEC( 1476) = -13 -3 9 11.9095 12 KVEC( 1477) = -16 -2 0 11.9325 12 KVEC( 1478) = -16 0 -2 11.9325 12 KVEC( 1479) = -14 -8 0 11.9325 12 KVEC( 1480) = -14 0 -8 11.9325 12 KVEC( 1481) = -12 -10 -4 11.9325 12 KVEC( 1482) = -12 -10 4 11.9325 12 KVEC( 1483) = -12 -4 -10 11.9325 12 KVEC( 1484) = -12 -4 10 11.9325 12 KVEC( 1485) = -16 -2 -1 11.9554 12 KVEC( 1486) = -16 -2 1 11.9554 12 KVEC( 1487) = -16 -1 -2 11.9554 12 KVEC( 1488) = -16 -1 2 11.9554 12 KVEC( 1489) = -15 -6 0 11.9554 12 KVEC( 1490) = -15 0 -6 11.9554 12 KVEC( 1491) = -14 -8 -1 11.9554 12 KVEC( 1492) = -14 -8 1 11.9554 12 KVEC( 1493) = -14 -7 -4 11.9554 12 KVEC( 1494) = -14 -7 4 11.9554 12 KVEC( 1495) = -14 -4 -7 11.9554 12 KVEC( 1496) = -14 -4 7 11.9554 12 KVEC( 1497) = -14 -1 -8 11.9554 12 KVEC( 1498) = -14 -1 8 11.9554 12 KVEC( 1499) = -12 -9 -6 11.9554 12 KVEC( 1500) = -12 -9 6 11.9554 12 KVEC( 1501) = -12 -6 -9 11.9554 12 KVEC( 1502) = -12 -6 9 11.9554 12 KVEC( 1503) = -15 -6 -1 11.9783 12 KVEC( 1504) = -15 -6 1 11.9783 12 KVEC( 1505) = -15 -1 -6 11.9783 12 KVEC( 1506) = -15 -1 6 11.9783 12 KVEC( 1507) = -10 -9 -9 11.9783 12 KVEC( 1508) = -10 -9 9 11.9783 12 SIZE INCLUDING STAR MEMBERS = 17845 time in recpr: 3.000000000000000E-002 Energy window: -0.0416 < E < 1.575 Greens function calculation for 4 atoms --------- atom 1 ------------- l= 2 qsplit= 2 No symmetrization over eq. k-points is performed The actual position of the atom 1 is: 0.135800 0.135800 0.135800 --------- atom 2 ------------- l= 2 qsplit= 2 No symmetrization over eq. k-points is performed The actual position of the atom 2 is: 0.364200 0.864200 0.635800 --------- atom 3 ------------- l= 2 qsplit= 2 No symmetrization over eq. k-points is performed The actual position of the atom 3 is: 0.635800 0.364200 0.864200 --------- atom 4 ------------- l= 2 qsplit= 2 No symmetrization over eq. k-points is performed The actual position of the atom 4 is: 0.864200 0.635800 0.364200 ********** Start Reading Cix file ************* Correlated block number 1 Correlated index= 1 0 0 0 0 0 2 0 0 0 0 0 3 0 0 0 0 0 4 0 0 0 0 0 5 Real part of unitary matrix= 0.0000 0.0000 1.0000 0.0000 0.0000 0.7071 0.0000 0.0000 0.0000 0.7071 0.0000 0.7071 0.0000 -0.7071 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 -0.7071 0.0000 0.0000 0.0000 0.7071 Imaginary part of unitary matrix= 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.7071 0.0000 0.7071 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 Correlated block number 2 Correlated index= 1 0 0 0 0 0 2 0 0 0 0 0 3 0 0 0 0 0 4 0 0 0 0 0 5 Real part of unitary matrix= 0.0000 0.0000 1.0000 0.0000 0.0000 0.7071 0.0000 0.0000 0.0000 0.7071 0.0000 0.7071 0.0000 -0.7071 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 -0.7071 0.0000 0.0000 0.0000 0.7071 Imaginary part of unitary matrix= 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.7071 0.0000 0.7071 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 Correlated block number 3 Correlated index= 1 0 0 0 0 0 2 0 0 0 0 0 3 0 0 0 0 0 4 0 0 0 0 0 5 Real part of unitary matrix= 0.0000 0.0000 1.0000 0.0000 0.0000 0.7071 0.0000 0.0000 0.0000 0.7071 0.0000 0.7071 0.0000 -0.7071 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 -0.7071 0.0000 0.0000 0.0000 0.7071 Imaginary part of unitary matrix= 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.7071 0.0000 0.7071 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 Correlated block number 4 Correlated index= 1 0 0 0 0 0 2 0 0 0 0 0 3 0 0 0 0 0 4 0 0 0 0 0 5 Real part of unitary matrix= 0.0000 0.0000 1.0000 0.0000 0.0000 0.7071 0.0000 0.0000 0.0000 0.7071 0.0000 0.7071 0.0000 -0.7071 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 -0.7071 0.0000 0.0000 0.0000 0.7071 Imaginary part of unitary matrix= 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.7071 0.0000 0.7071 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 At least one transformation matrix is not Identity BZ-integration with TETRA-program. icor=: 1 Equal occupancy of degenerate states, tol=: 0.1E-05 call eord... call dos... FERMI ENERGY AT 0.744626493272911 SUM RULE OF TETRAHEDRON INTEGRATION CHECKED call eweigh... number of occupied bands: 36 highest energy: 0.739703330173038 insulator ! EF-inconsistency corrected Bandranges (emin - emax) and occupancy: band 1 -3.1605591504 -3.1592279251 0.200000D+01 band 2 -3.1604511124 -3.1592155395 0.200000D+01 band 3 -3.1599577302 -3.1576392644 0.200000D+01 band 4 -3.1589786621 -3.1559721355 0.200000D+01 band 5 -3.1462763834 -3.1448166322 0.200000D+01 band 6 -3.1461347524 -3.1447996687 0.200000D+01 band 7 -3.1450916378 -3.1420829519 0.200000D+01 band 8 -3.1444852002 -3.1411332647 0.200000D+01 band 9 -3.1414156211 -3.1399180295 0.200000D+01 band 10 -3.1408356178 -3.1399132295 0.200000D+01 band 11 -3.1405838128 -3.1394598569 0.200000D+01 band 12 -3.1401840231 -3.1394516326 0.200000D+01 band 13 -0.1815390525 0.1061910961 0.200000D+01 band 14 -0.0418237545 0.2045948903 0.200000D+01 band 15 0.1076663093 0.2659775738 0.200000D+01 band 16 0.1131318883 0.2880535516 0.200000D+01 band 17 0.2674287103 0.4192916134 0.200000D+01 band 18 0.2899177587 0.4222854846 0.200000D+01 band 19 0.3149294095 0.4776087661 0.200000D+01 band 20 0.3170623321 0.5096237947 0.200000D+01 band 21 0.4775506579 0.5524861167 0.200000D+01 band 22 0.4848617498 0.5537301828 0.200000D+01 band 23 0.5238340900 0.5646714492 0.200000D+01 band 24 0.5248158938 0.5721649251 0.200000D+01 band 25 0.5569412957 0.5960498042 0.200000D+01 band 26 0.5687641876 0.5992910339 0.200000D+01 band 27 0.5713790704 0.6241887381 0.200000D+01 band 28 0.5722619001 0.6251541466 0.200000D+01 band 29 0.6005391046 0.6830584632 0.200000D+01 band 30 0.6135712113 0.6840731358 0.200000D+01 band 31 0.6173832248 0.6887367325 0.200000D+01 band 32 0.6534230468 0.7210587113 0.200000D+01 band 33 0.6705149997 0.7210587113 0.200000D+01 band 34 0.6710873464 0.7300220879 0.200000D+01 band 35 0.6920322744 0.7370145981 0.200000D+01 band 36 0.6924434624 0.7397033302 0.200000D+01 band 37 0.7470318496 0.7861870134 0.000000D+00 band 38 0.7521496321 0.7876306575 0.000000D+00 band 39 0.7766480582 0.8829415540 0.000000D+00 band 40 0.7771962763 0.9735704527 0.000000D+00 band 41 0.8987896562 1.1521592277 0.000000D+00 band 42 0.9020545414 1.1603068999 0.000000D+00 band 43 0.9702804745 1.1780879527 0.000000D+00 band 44 0.9832247070 1.1942987106 0.000000D+00 band 45 1.0374942456 1.2119526079 0.000000D+00 band 46 1.0586820901 1.2199967743 0.000000D+00 band 47 1.0599011646 1.2559775541 0.000000D+00 band 48 1.1378863038 1.2638310228 0.000000D+00 band 49 1.1933515775 1.3469047802 0.000000D+00 band 50 1.2094057678 1.3857542054 0.000000D+00 band 51 1.2241200442 1.4173232766 0.000000D+00 band 52 1.2840949451 1.4592390597 0.000000D+00 band 53 1.3312490935 1.5755065744 0.000000D+00 band 54 1.3748914212 1.5833079618 0.000000D+00 band 55 1.4415962969 1.6047016928 0.000000D+00 band 56 1.4916665173 1.6376829966 0.000000D+00 band 57 1.5065267214 1.7069057371 0.000000D+00 band 58 1.5114692266 1.7284887194 0.000000D+00 band 59 1.5330540261 1.8096737927 0.000000D+00 band 60 1.5356661754 1.8747505236 0.000000D+00 band 61 1.7265824318 1.8972665839 0.000000D+00 band 62 1.7517708769 2.0495342099 0.000000D+00 band 63 1.7896300000 2.0495342109 0.000000D+00 band 64 1.7910966598 2.0506634166 0.000000D+00 band 65 1.9089450860 2.1205710190 0.000000D+00 band 66 1.9254288763 2.1495674875 0.000000D+00 band 67 1.9664272668 2.1747359060 0.000000D+00 band 68 1.9796608806 2.2181563990 0.000000D+00 band 69 2.0694518927 2.2369332615 0.000000D+00 band 70 2.0886642727 2.2663850865 0.000000D+00 band 71 2.1699047058 2.3174374054 0.000000D+00 band 72 2.1780776348 2.3380468914 0.000000D+00 band 73 2.2462574484 2.3741847598 0.000000D+00 band 74 2.2690486725 2.4748174183 0.000000D+00 band 75 2.3178023722 2.4818013158 0.000000D+00 band 76 2.3480973593 2.4978555299 0.000000D+00 band 77 2.4161445992 2.5150217082 0.000000D+00 band 78 2.4262940900 2.5507029071 0.000000D+00 band 79 2.4923013126 2.6115592837 0.000000D+00 band 80 2.5108607934 2.6300411261 0.000000D+00 band 81 2.5434684445 2.6620369588 0.000000D+00 band 82 2.5511762660 2.7227982065 0.000000D+00 band 83 2.6011640708 2.7456125229 0.000000D+00 band 84 2.6082521077 2.7738696100 0.000000D+00 band 85 2.7110472774 2.8318843299 0.000000D+00 band 86 2.7444283983 2.8885653371 0.000000D+00 band 87 2.7449710842 2.8938616079 0.000000D+00 band 88 2.7490464816 2.9152368666 0.000000D+00 band 89 2.8522905074 2.9945494579 0.000000D+00 band 90 2.8684751576 2.9986553595 0.000000D+00 band 91 2.9032784666 2.9996374884 0.000000D+00 band 92 2.9310309787 2.9986374871 0.000000D+00 band 93 2.9691713723 2.9994843105 0.000000D+00 eseper below EF 0.500000000000000 eseper minimum gap 5.000000000000000E-002 Energy to separate semicore and valence states: -0.231539052462286 :NLDA : NUMBER OF ELECTRONS = 72.000 :FLDA : F E R M I - ENERGY(TETRAH.M.)= 0.73970 wmist 72.0000000001001 icase,lcase,icix,iorb,nind1,ip1,iSx= 1 1 1 1 5 1 1 icase,lcase,icix,iorb,nind1,ip1,iSx= 1 1 1 1 5 2 2 icase,lcase,icix,iorb,nind1,ip1,iSx= 1 1 1 1 5 3 3 icase,lcase,icix,iorb,nind1,ip1,iSx= 1 1 1 1 5 4 4 icase,lcase,icix,iorb,nind1,ip1,iSx= 1 1 1 1 5 5 5 icase,lcase,icix,iorb,nind1,ip1,iSx= 2 1 2 2 5 1 1 icase,lcase,icix,iorb,nind1,ip1,iSx= 2 1 2 2 5 2 2 icase,lcase,icix,iorb,nind1,ip1,iSx= 2 1 2 2 5 3 3 icase,lcase,icix,iorb,nind1,ip1,iSx= 2 1 2 2 5 4 4 icase,lcase,icix,iorb,nind1,ip1,iSx= 2 1 2 2 5 5 5 icase,lcase,icix,iorb,nind1,ip1,iSx= 3 1 3 3 5 1 1 icase,lcase,icix,iorb,nind1,ip1,iSx= 3 1 3 3 5 2 2 icase,lcase,icix,iorb,nind1,ip1,iSx= 3 1 3 3 5 3 3 icase,lcase,icix,iorb,nind1,ip1,iSx= 3 1 3 3 5 4 4 icase,lcase,icix,iorb,nind1,ip1,iSx= 3 1 3 3 5 5 5 icase,lcase,icix,iorb,nind1,ip1,iSx= 4 1 4 4 5 1 1 icase,lcase,icix,iorb,nind1,ip1,iSx= 4 1 4 4 5 2 2 icase,lcase,icix,iorb,nind1,ip1,iSx= 4 1 4 4 5 3 3 icase,lcase,icix,iorb,nind1,ip1,iSx= 4 1 4 4 5 4 4 icase,lcase,icix,iorb,nind1,ip1,iSx= 4 1 4 4 5 5 5 cixdim( 1)= 5 noccur( 1, 1)= 1 noccur( 2, 1)= 1 noccur( 3, 1)= 1 noccur( 4, 1)= 1 noccur( 5, 1)= 1 cixdim( 2)= 5 noccur( 1, 2)= 1 noccur( 2, 2)= 1 noccur( 3, 2)= 1 noccur( 4, 2)= 1 noccur( 5, 2)= 1 cixdim( 3)= 5 noccur( 1, 3)= 1 noccur( 2, 3)= 1 noccur( 3, 3)= 1 noccur( 4, 3)= 1 noccur( 5, 3)= 1 cixdim( 4)= 5 noccur( 1, 4)= 1 noccur( 2, 4)= 1 noccur( 3, 4)= 1 noccur( 4, 4)= 1 noccur( 5, 4)= 1 iSx( 1, 1)= 1 iSx( 2, 1)= 2 iSx( 3, 1)= 3 iSx( 4, 1)= 4 iSx( 5, 1)= 5 iSx( 1, 2)= 1 iSx( 2, 2)= 2 iSx( 3, 2)= 3 iSx( 4, 2)= 4 iSx( 5, 2)= 5 iSx( 1, 3)= 1 iSx( 2, 3)= 2 iSx( 3, 3)= 3 iSx( 4, 3)= 4 iSx( 5, 3)= 5 iSx( 1, 4)= 1 iSx( 2, 4)= 2 iSx( 3, 4)= 3 iSx( 4, 4)= 4 iSx( 5, 4)= 5 nindo( 1)= 5 nindo( 2)= 5 nindo( 3)= 5 nindo( 4)= 5 CF for iorb1= 1 iorb2= 1 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.70710679 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.70710679 0.00000000 0.00000000 0.00000000 0.70710679 0.00000000 0.00000000 0.00000000 -0.70710679 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.70710679 0.00000000 0.00000000 0.00000000 0.70710679 0.00000000 0.00000000 -0.70710679 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.70710679 0.00000000 CF for iorb1= 2 iorb2= 2 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.70710679 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.70710679 0.00000000 0.00000000 0.00000000 0.70710679 0.00000000 0.00000000 0.00000000 -0.70710679 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.70710679 0.00000000 0.00000000 0.00000000 0.70710679 0.00000000 0.00000000 -0.70710679 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.70710679 0.00000000 CF for iorb1= 3 iorb2= 3 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.70710679 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.70710679 0.00000000 0.00000000 0.00000000 0.70710679 0.00000000 0.00000000 0.00000000 -0.70710679 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.70710679 0.00000000 0.00000000 0.00000000 0.70710679 0.00000000 0.00000000 -0.70710679 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.70710679 0.00000000 CF for iorb1= 4 iorb2= 4 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.70710679 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.70710679 0.00000000 0.00000000 0.00000000 0.70710679 0.00000000 0.00000000 0.00000000 -0.70710679 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.70710679 0.00000000 0.00000000 0.00000000 0.70710679 0.00000000 0.00000000 -0.70710679 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.70710679 0.00000000 atom 1 ncomu 0 lmmax 17 LMMAX 17 LM= 0 0 1 0 2 0 3 0 3 3 -3 3 4 0 4 3 -4 3 5 0 5 3 -5 3 6 0 6 3 -6 3 6 6 -6 6 atom 2 ncomu 0 lmmax 17 LMMAX 17 LM= 0 0 1 0 2 0 3 0 3 3 -3 3 4 0 4 3 -4 3 5 0 5 3 -5 3 6 0 6 3 -6 3 6 6 -6 6 :POS001: AT.NR. -1 POSITION = 0.13580 0.13580 0.13580 MULTIPLICITY = 4 NOT EQUIV ATOM Fe1 LOCAL ROTATION MATRIX 0.70711 0.40825 0.57735 -0.70711 0.40825 0.57735 0.00000 -0.81650 0.57735 EQUIV ATOM 1 POSITION: 0.136 0.136 0.136 0.00000 1.00000 0.00000 0.00000 0.00000 0.00000 1.00000 0.00000 1.00000 0.00000 0.00000 0.00000 EQUIV ATOM 2 POSITION: 0.364 0.864 0.636 0.00000 0.00000 -1.00000 0.50000 -1.00000 0.00000 0.00000 0.00000 0.00000 1.00000 0.00000 0.50000 EQUIV ATOM 3 POSITION: 0.636 0.364 0.864 0.00000 0.00000 1.00000 0.50000 -1.00000 0.00000 0.00000 0.50000 0.00000 -1.00000 0.00000 0.00000 EQUIV ATOM 4 POSITION: 0.864 0.636 0.364 0.00000 -1.00000 0.00000 0.00000 0.00000 0.00000 1.00000 0.50000 -1.00000 0.00000 0.00000 0.50000 ATOMIC PARAMETERS FOR Fe1 ENERGY PARAMETERS ARE 0.26 0.44 0.63 0.57 0.57 0.57 0.57 ENERGY PARAMETERS ARE 0.57 0.57 L U(R) U'(R) DU/DE DU'/DE NORM-U' 0 -0.571450E+00 0.220617E-01 0.104332E+00 0.338588E+00 0.129943E-01 3 3 3 0 -0.571450E+00 0.220617E-01 0.104332E+00 0.338588E+00 0.129943E-01 3 3 3 1 0.637522E+00 0.191879E+00 -0.774756E-01 -0.330438E+00 0.128491E-01 2 2 2 1 0.637522E+00 0.191879E+00 -0.774756E-01 -0.330438E+00 0.128491E-01 2 2 2 2 0.193958E+00 -0.159182E+00 -0.573716E+00 -0.538748E+00 0.579459E+00 0 0 0 2 0.193958E+00 -0.159182E+00 -0.573716E+00 -0.538748E+00 0.579459E+00 0 0 0 3 0.810626E+00 0.848141E+00 -0.591691E-01 -0.303434E+00 0.373161E-02 0 0 0 3 0.810626E+00 0.848141E+00 -0.591691E-01 -0.303434E+00 0.373161E-02 0 0 0 4 0.932590E+00 0.146286E+01 -0.399047E-01 -0.272529E+00 0.134403E-02 0 0 0 4 0.932590E+00 0.146286E+01 -0.399047E-01 -0.272529E+00 0.134403E-02 0 0 0 5 0.103047E+01 0.211546E+01 -0.302744E-01 -0.252139E+00 0.659592E-03 0 0 0 5 0.103047E+01 0.211546E+01 -0.302744E-01 -0.252139E+00 0.659592E-03 0 0 0 6 0.111649E+01 0.281582E+01 -0.242346E-01 -0.236464E+00 0.371692E-03 0 0 0 6 0.111649E+01 0.281582E+01 -0.242346E-01 -0.236464E+00 0.371692E-03 0 0 0 7 0.119480E+01 0.356430E+01 -0.200562E-01 -0.223676E+00 0.228056E-03 0 0 0 7 0.119480E+01 0.356430E+01 -0.200562E-01 -0.223676E+00 0.228056E-03 0 0 0 8 0.126744E+01 0.435943E+01 -0.169921E-01 -0.212892E+00 0.148560E-03 0 0 0 8 0.126744E+01 0.435943E+01 -0.169921E-01 -0.212892E+00 0.148560E-03 0 0 0 LO COEFFICIENT: l,A,B,C 0 0.84824 4.64602 0.00000 1 -0.627829E-01 0.945488E-01 0 1 0 LO COEFFICIENT: l,A,B,C 1 0.73127 6.01736 0.00000 LO COEFFICIENT: l,A,B,C 1 0.09704 0.00000 0.98538 LO COEFFICIENT: l,A,B,C 2 0.96844 0.32741 0.00000 :POS002: AT.NR. -2 POSITION = 0.84400 0.84400 0.84400 MULTIPLICITY = 4 NOT EQUIV ATOM Si2 LOCAL ROTATION MATRIX 0.70711 0.40825 0.57735 -0.70711 0.40825 0.57735 0.00000 -0.81650 0.57735 EQUIV ATOM 1 POSITION: 0.844 0.844 0.844 0.00000 1.00000 0.00000 0.00000 0.00000 0.00000 1.00000 0.00000 1.00000 0.00000 0.00000 0.00000 EQUIV ATOM 2 POSITION: 0.656 0.156 0.344 0.00000 0.00000 -1.00000 0.50000 -1.00000 0.00000 0.00000 0.00000 0.00000 1.00000 0.00000 0.50000 EQUIV ATOM 3 POSITION: 0.344 0.656 0.156 0.00000 0.00000 1.00000 0.50000 -1.00000 0.00000 0.00000 0.50000 0.00000 -1.00000 0.00000 0.00000 EQUIV ATOM 4 POSITION: 0.156 0.344 0.656 0.00000 -1.00000 0.00000 0.00000 0.00000 0.00000 1.00000 0.50000 -1.00000 0.00000 0.00000 0.50000 ATOMIC PARAMETERS FOR Si2 ENERGY PARAMETERS ARE 0.15 0.46 0.59 0.57 0.57 0.57 0.57 ENERGY PARAMETERS ARE 0.57 0.57 L U(R) U'(R) DU/DE DU'/DE NORM-U' 0 0.553457E+00 -0.293059E+00 -0.139381E+00 -0.377911E+00 0.169493E-01 2 2 2 0 0.553457E+00 -0.293059E+00 -0.139381E+00 -0.377911E+00 0.169493E-01 2 2 2 1 -0.634753E+00 0.967159E-01 0.120337E+00 0.375541E+00 0.131584E-01 1 1 1 1 -0.634753E+00 0.967159E-01 0.120337E+00 0.375541E+00 0.131584E-01 1 1 1 2 0.747568E+00 0.293707E+00 -0.105207E+00 -0.375765E+00 0.105850E-01 0 0 0 2 0.747568E+00 0.293707E+00 -0.105207E+00 -0.375765E+00 0.105850E-01 0 0 0 3 0.971245E+00 0.111546E+01 -0.543283E-01 -0.319799E+00 0.206704E-02 0 0 0 3 0.971245E+00 0.111546E+01 -0.543283E-01 -0.319799E+00 0.206704E-02 0 0 0 4 0.111469E+01 0.194210E+01 -0.376947E-01 -0.289948E+00 0.820158E-03 0 0 0 4 0.111469E+01 0.194210E+01 -0.376947E-01 -0.289948E+00 0.820158E-03 0 0 0 5 0.123283E+01 0.282930E+01 -0.286967E-01 -0.268633E+00 0.409423E-03 0 0 0 5 0.123283E+01 0.282930E+01 -0.286967E-01 -0.268633E+00 0.409423E-03 0 0 0 6 0.133699E+01 0.378276E+01 -0.229647E-01 -0.251943E+00 0.231426E-03 0 0 0 6 0.133699E+01 0.378276E+01 -0.229647E-01 -0.251943E+00 0.231426E-03 0 0 0 7 0.143177E+01 0.480162E+01 -0.189859E-01 -0.238254E+00 0.141917E-03 0 0 0 7 0.143177E+01 0.480162E+01 -0.189859E-01 -0.238254E+00 0.141917E-03 0 0 0 8 0.151959E+01 0.588353E+01 -0.160686E-01 -0.226697E+00 0.923099E-04 0 0 0 8 0.151959E+01 0.588353E+01 -0.160686E-01 -0.226697E+00 0.923099E-04 0 0 0 LO COEFFICIENT: l,A,B,C 0 0.88832 3.52735 0.00000 LO COEFFICIENT: l,A,B,C 1 0.85557 4.51296 0.00000 LO COEFFICIENT: l,A,B,C 2 0.80728 5.73627 0.00000 pr_proc= 38 tot-k=451 pr_proc= 38 tot-k=451 :NOE : NUMBER OF ELECTRONS = 72.000 :FER : F E R M I - ENERGY = 0.81540 max k indices: 5 5 5 n,iff1,iff2,iff3 515 27 27 27 pr_proc= 38 tot-k=451 =====>>> CPU TIME SUMMARY TOTAL : 303.5 ... 100. PERCENT PART FERMI : 0.2 ... 0. PERCENT PART CLM : 303.3 ... 100. PERCENT PART FOURIR : 0.0 ... 0. PERCENT =====>>> WALL TIME SUMMARY TOTAL : ******** ... 100. PERCENT PART FERMI : 0.2 ... 0. PERCENT PART CLM : ******** ... 100. PERCENT PART FOURIR : 0.0 ... 0. PERCENT