0 mol 54 unq 0 iso 0 dist 8.62769 12.8594 6.09782 5.17091 7.16132 10.763 numMergedOcc 0
1 mol 54 unq 0 iso 1 dist 6.09782 12.8594 8.62769 10.763 7.16132 5.17091 numMergedOcc 0
2 mol 64 unq 0 iso 0 dist 9.10915 6.90646 8.66921 6.24019 9.86334 7.01498 numMergedOcc 0
3 mol 64 unq 0 iso 1 dist 8.66921 6.90646 9.10915 7.01498 9.86334 6.24019 numMergedOcc 0
4 mol 64 unq 1 iso 0 dist 9.10915 7.89535 5.54343 6.24019 9.86334 5.18166 numMergedOcc 0
5 mol 64 unq 1 iso 1 dist 5.54343 7.89535 9.10915 5.18166 9.86334 6.24019 numMergedOcc 0
6 mol 64 unq 1 iso 0 dist 8.66921 6.36389 5.54343 7.01498 9.86334 5.18166 numMergedOcc 0
7 mol 64 unq 1 iso 1 dist 5.54343 6.36389 8.66921 5.18166 9.86334 7.01498 numMergedOcc 0
8 mol 68 unq 0 iso 0 dist 6.87176 7.08944 5.57389 8.41932 7.39665 8.95801 numMergedOcc 0
9 mol 68 unq 0 iso 1 dist 5.57389 7.08944 6.87176 8.95801 7.39665 8.41932 numMergedOcc 0
10 mol 73 unq 0 iso 0 dist 5.79954 8.4863 7.01889 11.5216 9.73086 16.3376 numMergedOcc 0
11 mol 73 unq 0 iso 1 dist 7.01889 8.4863 5.79954 16.3376 9.73086 11.5216 numMergedOcc 0
12 mol 76 unq 0 iso 0 dist 4.83274 10.5047 7.89214 8.55291 9.6952 13.2696 numMergedOcc 0
13 mol 76 unq 0 iso 1 dist 7.89214 10.5047 4.83274 13.2696 9.6952 8.55291 numMergedOcc 0
14 mol 127 unq 0 iso 0 dist 7.73139 8.63406 6.66607 4.66329 6.08673 7.30158 numMergedOcc 0
15 mol 127 unq 0 iso 1 dist 6.66607 8.63406 7.73139 7.30158 6.08673 4.66329 numMergedOcc 0
16 mol 127 unq 1 iso 0 dist 7.73139 6.87199 8.62711 4.66329 6.08673 9.74982 numMergedOcc 0
17 mol 127 unq 1 iso 1 dist 8.62711 6.87199 7.73139 9.74982 6.08673 4.66329 numMergedOcc 0
18 mol 127 unq 1 iso 0 dist 6.66607 12.663 8.62711 7.30158 6.08673 9.74982 numMergedOcc 0
19 mol 127 unq 1 iso 1 dist 8.62711 12.663 6.66607 9.74982 6.08673 7.30158 numMergedOcc 0
20 mol 132 unq 0 iso 0 dist 6.2403 11.8902 6.495 11.6543 6.89918 7.05332 numMergedOcc 0
21 mol 132 unq 0 iso 1 dist 6.495 11.8902 6.2403 7.05332 6.89918 11.6543 numMergedOcc 0
22 mol 132 unq 1 iso 0 dist 8.34869 11.8902 9.43748 11.6543 7.89457 7.05332 numMergedOcc 0
23 mol 132 unq 1 iso 1 dist 9.43748 11.8902 8.34869 7.05332 7.89457 11.6543 numMergedOcc 0
24 mol 214 unq 0 iso 0 dist 9.40003 17.6476 8.68385 7.66602 7.46481 15.5553 numMergedOcc 0
25 mol 214 unq 0 iso 1 dist 8.68385 17.6476 9.40003 15.5553 7.46481 7.66602 numMergedOcc 0
26 mol 219 unq 0 iso 0 dist 9.68515 10.4254 8.09769 9.32356 4.33238 4.74338 numMergedOcc 0
27 mol 219 unq 0 iso 1 dist 8.09769 10.4254 9.68515 4.74338 4.33238 9.32356 numMergedOcc 0
28 mol 219 unq 1 iso 0 dist 9.68515 11.7281 6.75833 9.32356 4.33238 6.17123 numMergedOcc 0
29 mol 219 unq 1 iso 1 dist 6.75833 11.7281 9.68515 6.17123 4.33238 9.32356 numMergedOcc 0
30 mol 219 unq 1 iso 0 dist 8.09769 10.676 6.75833 4.74338 4.33238 6.17123 numMergedOcc 0
31 mol 219 unq 1 iso 1 dist 6.75833 10.676 8.09769 6.17123 4.33238 4.74338 numMergedOcc 0
32 mol 279 unq 0 iso 0 dist 6.47376 6.22487 9.6147 4.91802 6.35028 9.35656 numMergedOcc 0
33 mol 279 unq 0 iso 1 dist 9.6147 6.22487 6.47376 9.35656 6.35028 4.91802 numMergedOcc 0
