---------------- ATOM 1 SHELL: 1 4.54148856148024 4 1002.00000000000 SHELL: 2 5.29482550000000 2 1000.00000000000 2 1001.00000000000 SHELL: 3 7.19962113696969 4 1003.00000000000 SHELL: 4 7.48801403249890 4 1001.00000000000 SHELL: 5 8.75759513250963 8 1002.00000000000 SHELL: 6 10.3877282726687 8 1003.00000000000 SHELL: 7 10.4241542520844 4 1002.00000000000 SHELL: 8 10.5896510000000 4 1000.00000000000 SHELL: 9 11.5224054196967 4 1002.00000000000 SHELL: 10 11.8395897469993 4 1000.00000000000 4 1001.00000000000 SHELL: 11 12.2990985000000 2 1001.00000000000 SHELL: 12 12.8052822232742 4 1003.00000000000 SHELL: 13 12.8348488897279 8 1002.00000000000 SHELL: 14 13.3904070508761 4 1000.00000000000 4 1001.00000000000 SHELL: 15 13.7417677467914 8 1002.00000000000 SHELL: 16 14.3992422739394 8 1000.00000000000 SHELL: 17 14.8339343051195 8 1003.00000000000 SHELL: 18 14.8594650029215 4 1002.00000000000 SHELL: 19 14.9760280649978 4 1000.00000000000 SHELL: 20 15.3337175095365 4 1002.00000000000 SHELL: 21 15.6494899264372 8 1002.00000000000 SHELL: 22 15.8844765000000 2 1001.00000000000 2 1000.00000000000 ---------------- ATOM 2 SHELL: 1 4.54148856148024 4 1002.00000000000 SHELL: 2 5.29482550000000 2 1001.00000000000 2 1000.00000000000 SHELL: 3 7.19962113696969 4 1003.00000000000 SHELL: 4 7.48801403249890 4 1001.00000000000 SHELL: 5 8.75759513250963 8 1002.00000000000 SHELL: 6 10.3877282726687 8 1003.00000000000 SHELL: 7 10.4241542520844 4 1002.00000000000 SHELL: 8 10.5896510000000 4 1000.00000000000 SHELL: 9 11.5224054196967 4 1002.00000000000 SHELL: 10 11.8395897469993 4 1000.00000000000 4 1001.00000000000 SHELL: 11 12.2990985000000 2 1001.00000000000 SHELL: 12 12.8052822232742 4 1003.00000000000 SHELL: 13 12.8348488897279 8 1002.00000000000 SHELL: 14 13.3904070508761 4 1000.00000000000 4 1001.00000000000 SHELL: 15 13.7417677467914 8 1002.00000000000 SHELL: 16 14.3992422739394 8 1000.00000000000 SHELL: 17 14.8339343051195 8 1003.00000000000 SHELL: 18 14.8594650029215 4 1002.00000000000 SHELL: 19 14.9760280649978 4 1000.00000000000 SHELL: 20 15.3337175095365 4 1002.00000000000 SHELL: 21 15.6494899264372 8 1002.00000000000 SHELL: 22 15.8844765000000 2 1001.00000000000 2 1000.00000000000 ---------------- ATOM 3 SHELL: 1 4.54148856148024 4 1002.00000000000 SHELL: 2 5.29482550000000 2 1000.00000000000 2 1001.00000000000 SHELL: 3 7.19962113696969 4 1003.00000000000 SHELL: 4 7.48801403249890 4 1000.00000000000 SHELL: 5 8.75759513250963 8 1002.00000000000 SHELL: 6 10.3877282726687 8 1003.00000000000 SHELL: 7 10.4241542520844 4 1002.00000000000 SHELL: 8 10.5896510000000 4 1001.00000000000 SHELL: 9 11.5224054196967 4 1002.00000000000 SHELL: 10 11.8395897469993 4 1001.00000000000 4 1000.00000000000 SHELL: 11 12.2990985000000 2 1000.00000000000 SHELL: 12 12.8052822232742 4 1003.00000000000 SHELL: 13 12.8348488897279 8 1002.00000000000 SHELL: 14 13.3904070508761 4 1000.00000000000 4 1001.00000000000 SHELL: 15 13.7417677467914 8 1002.00000000000 SHELL: 16 14.3992422739394 8 1001.00000000000 SHELL: 17 14.8339343051195 8 1003.00000000000 SHELL: 18 14.8594650029215 4 1002.00000000000 SHELL: 19 14.9760280649978 4 1001.00000000000 SHELL: 20 15.3337175095365 4 1002.00000000000 SHELL: 21 15.6494899264372 8 1002.00000000000 SHELL: 22 15.8844765000000 2 1000.00000000000 2 1001.00000000000 ---------------- ATOM 4 SHELL: 1 4.54148856148024 4 1002.00000000000 SHELL: 2 5.29482550000000 2 1000.00000000000 2 1001.00000000000 SHELL: 3 7.19962113696969 4 1003.00000000000 SHELL: 4 7.48801403249890 4 1000.00000000000 SHELL: 5 8.75759513250963 8 1002.00000000000 SHELL: 6 10.3877282726687 8 1003.00000000000 SHELL: 7 10.4241542520844 4 1002.00000000000 SHELL: 8 10.5896510000000 4 1001.00000000000 SHELL: 9 11.5224054196967 4 1002.00000000000 SHELL: 10 11.8395897469993 4 1000.00000000000 4 1001.00000000000 SHELL: 11 12.2990985000000 2 1000.00000000000 SHELL: 12 12.8052822232742 4 1003.00000000000 SHELL: 13 12.8348488897279 8 1002.00000000000 SHELL: 14 13.3904070508761 4 1001.00000000000 4 1000.00000000000 SHELL: 15 13.7417677467914 8 1002.00000000000 SHELL: 16 14.3992422739394 8 1001.00000000000 SHELL: 17 14.8339343051195 8 1003.00000000000 SHELL: 18 14.8594650029215 4 1002.00000000000 SHELL: 19 14.9760280649978 4 1001.00000000000 SHELL: 20 15.3337175095365 4 1002.00000000000 SHELL: 21 15.6494899264372 8 1002.00000000000 SHELL: 22 15.8844765000000 2 1000.00000000000 2 1001.00000000000 ---------------- ATOM 5 SHELL: 1 4.54148856148024 2 1000.00000000000 2 1001.00000000000 SHELL: 2 6.39098487497833 4 1003.00000000000 SHELL: 3 7.15807532700000 1 1002.00000000000 SHELL: 4 7.38006072744481 4 1002.00000000000 SHELL: 5 7.48801403249890 4 1002.00000000000 SHELL: 6 8.72006083650000 1 1003.00000000000 SHELL: 7 8.75759513250963 4 1001.00000000000 4 1000.00000000000 SHELL: 8 10.3589766163413 4 1002.00000000000 SHELL: 9 10.4241542520844 2 1001.00000000000 2 1000.00000000000 SHELL: 10 10.5896510000000 4 1002.00000000000 SHELL: 11 11.4939033901961 4 1003.00000000000 SHELL: 12 11.5224054196967 2 1001.00000000000 2 1000.00000000000 SHELL: 13 12.3687265300031 8 1003.00000000000 SHELL: 14 12.7819697499567 4 1002.00000000000 SHELL: 15 12.8348488897279 4 1000.00000000000 4 1001.00000000000 SHELL: 16 12.9075948434468 8 1002.00000000000 SHELL: 17 13.3904070508761 8 1002.00000000000 SHELL: 18 13.7178777255836 4 1003.00000000000 SHELL: 19 13.7417677467914 4 1000.00000000000 4 1001.00000000000 SHELL: 20 14.8594650029215 2 1000.00000000000 2 1001.00000000000 SHELL: 21 14.9760280649978 4 1002.00000000000 SHELL: 22 15.3337175095365 2 1001.00000000000 2 1000.00000000000 SHELL: 23 15.6494899264372 4 1000.00000000000 4 1001.00000000000 SHELL: 24 15.8781361635000 1 1003.00000000000 ---------------- ATOM 6 SHELL: 1 4.54148856148024 2 1001.00000000000 2 1000.00000000000 SHELL: 2 6.39098487497833 4 1003.00000000000 SHELL: 3 7.15807532700000 1 1002.00000000000 SHELL: 4 7.38006072744481 4 1002.00000000000 SHELL: 5 7.48801403249890 4 1002.00000000000 SHELL: 6 8.72006083650000 1 1003.00000000000 SHELL: 7 8.75759513250963 4 1000.00000000000 4 1001.00000000000 SHELL: 8 10.3589766163413 4 1002.00000000000 SHELL: 9 10.4241542520844 2 1000.00000000000 2 1001.00000000000 SHELL: 10 10.5896510000000 4 1002.00000000000 SHELL: 11 11.4939033901961 4 1003.00000000000 SHELL: 12 11.5224054196967 2 1000.00000000000 2 1001.00000000000 SHELL: 13 12.3687265300031 8 1003.00000000000 SHELL: 14 12.7819697499567 4 1002.00000000000 SHELL: 15 12.8348488897279 4 1001.00000000000 4 1000.00000000000 SHELL: 16 12.9075948434468 8 1002.00000000000 SHELL: 17 13.3904070508761 8 1002.00000000000 SHELL: 18 13.7178777255836 4 1003.00000000000 SHELL: 19 13.7417677467914 4 1001.00000000000 4 1000.00000000000 SHELL: 20 14.8594650029215 2 1001.00000000000 2 1000.00000000000 SHELL: 21 14.9760280649978 4 1002.00000000000 SHELL: 22 15.3337175095365 2 1000.00000000000 2 1001.00000000000 SHELL: 23 15.6494899264372 4 1000.00000000000 4 1001.00000000000 SHELL: 24 15.8781361635000 1 1003.00000000000 ---------------- ATOM 7 SHELL: 1 4.54148856148024 2 1000.00000000000 2 1001.00000000000 SHELL: 2 6.39098487497833 4 1003.00000000000 SHELL: 3 7.15807532700000 1 1002.00000000000 SHELL: 4 7.38006072744481 4 1002.00000000000 SHELL: 5 7.48801403249890 4 1002.00000000000 SHELL: 6 8.72006083650000 1 1003.00000000000 SHELL: 7 8.75759513250963 4 1000.00000000000 4 1001.00000000000 SHELL: 8 10.3589766163413 4 1002.00000000000 SHELL: 9 10.4241542520844 2 1001.00000000000 2 1000.00000000000 SHELL: 10 10.5896510000000 4 1002.00000000000 SHELL: 11 11.4939033901961 4 1003.00000000000 SHELL: 12 11.5224054196967 2 1001.00000000000 2 1000.00000000000 SHELL: 13 12.3687265300031 8 1003.00000000000 SHELL: 14 12.7819697499567 4 1002.00000000000 SHELL: 15 12.8348488897279 4 1000.00000000000 4 1001.00000000000 SHELL: 16 12.9075948434468 8 1002.00000000000 SHELL: 17 13.3904070508761 8 1002.00000000000 SHELL: 18 13.7178777255836 4 1003.00000000000 SHELL: 19 13.7417677467914 4 1000.00000000000 4 1001.00000000000 SHELL: 20 14.8594650029215 2 1000.00000000000 2 1001.00000000000 SHELL: 21 14.9760280649978 4 1002.00000000000 SHELL: 22 15.3337175095365 2 1001.00000000000 2 1000.00000000000 SHELL: 23 15.6494899264372 4 1000.00000000000 4 1001.00000000000 SHELL: 24 15.8781361635000 1 1003.00000000000 ---------------- ATOM 8 SHELL: 1 4.54148856148024 2 1001.00000000000 2 1000.00000000000 SHELL: 2 6.39098487497833 4 1003.00000000000 SHELL: 3 7.15807532700000 1 1002.00000000000 SHELL: 4 7.38006072744481 4 1002.00000000000 SHELL: 5 7.48801403249890 4 1002.00000000000 SHELL: 6 8.72006083650000 1 1003.00000000000 SHELL: 7 8.75759513250963 4 1000.00000000000 4 1001.00000000000 SHELL: 8 10.3589766163413 4 1002.00000000000 SHELL: 9 10.4241542520844 2 1000.00000000000 2 1001.00000000000 SHELL: 10 10.5896510000000 4 1002.00000000000 SHELL: 11 11.4939033901961 4 1003.00000000000 SHELL: 12 11.5224054196967 2 1000.00000000000 2 1001.00000000000 SHELL: 13 12.3687265300031 8 1003.00000000000 SHELL: 14 12.7819697499567 4 1002.00000000000 SHELL: 15 12.8348488897279 4 1000.00000000000 4 1001.00000000000 SHELL: 16 12.9075948434468 8 1002.00000000000 SHELL: 17 13.3904070508761 8 1002.00000000000 SHELL: 18 13.7178777255836 4 1003.00000000000 SHELL: 19 13.7417677467914 4 1001.00000000000 4 1000.00000000000 SHELL: 20 14.8594650029215 2 1001.00000000000 2 1000.00000000000 SHELL: 21 14.9760280649978 4 1002.00000000000 SHELL: 22 15.3337175095365 2 1000.00000000000 2 1001.00000000000 SHELL: 23 15.6494899264372 4 1001.00000000000 4 1000.00000000000 SHELL: 24 15.8781361635000 1 1003.00000000000 ---------------- ATOM 9 SHELL: 1 6.39098487497833 8 1002.00000000000 SHELL: 2 7.19962113696969 4 1000.00000000000 4 1001.00000000000 SHELL: 3 7.48801403249890 4 1003.00000000000 SHELL: 4 8.72006083650000 2 1002.00000000000 SHELL: 5 10.3877282726687 8 1000.00000000000 8 1001.00000000000 SHELL: 6 10.5896510000000 4 1003.00000000000 SHELL: 7 11.4939033901961 8 1002.00000000000 SHELL: 8 12.3687265300031 16 1002.00000000000 SHELL: 9 12.8052822232742 4 1000.00000000000 4 1001.00000000000 SHELL: 10 13.3904070508761 8 1003.00000000000 SHELL: 11 13.7178777255836 8 1002.00000000000 SHELL: 12 14.8339343051195 8 1000.00000000000 8 1001.00000000000 SHELL: 13 14.9760280649978 4 1003.00000000000 SHELL: 14 15.8781361635000 2 1002.00000000000 ---------------- ATOM 10 SHELL: 1 6.39098487497833 8 1002.00000000000 SHELL: 2 7.19962113696969 4 1000.00000000000 4 1001.00000000000 SHELL: 3 7.48801403249890 4 1003.00000000000 SHELL: 4 8.72006083650000 2 1002.00000000000 SHELL: 5 10.3877282726687 8 1000.00000000000 8 1001.00000000000 SHELL: 6 10.5896510000000 4 1003.00000000000 SHELL: 7 11.4939033901961 8 1002.00000000000 SHELL: 8 12.3687265300031 16 1002.00000000000 SHELL: 9 12.8052822232742 4 1000.00000000000 4 1001.00000000000 SHELL: 10 13.3904070508761 8 1003.00000000000 SHELL: 11 13.7178777255836 8 1002.00000000000 SHELL: 12 14.8339343051195 8 1000.00000000000 8 1001.00000000000 SHELL: 13 14.9760280649978 4 1003.00000000000 SHELL: 14 15.8781361635000 2 1002.00000000000