0 mol 1 unq 0 iso 0 dist 9.40771 6.13271 6.86701 7.90358 5.96833 5.11735 numMergedOcc 0
1 mol 1 unq 1 iso 0 dist 8.7275 9.02078 6.86701 6.03793 5.96833 5.11735 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 7.93454 10.6266 7.18022 14.28 7.79336 5.32981 numMergedOcc 0
3 mol 34 unq 1 iso 0 dist 9.06898 10.6266 6.24711 14.28 7.08559 5.32981 numMergedOcc 0
4 mol 34 unq 2 iso 0 dist 9.06898 10.6266 6.24711 10.7254 8.63635 8.90278 numMergedOcc 0
5 mol 67 unq 0 iso 0 dist 6.89527 6.27668 8.3733 4.39526 8.96498 10.331 numMergedOcc 0
6 mol 76 unq 0 iso 0 dist 8.18572 13.7055 8.13108 8.36307 9.4866 10.963 numMergedOcc 0
7 mol 76 unq 1 iso 0 dist 8.18572 13.7055 8.13108 10.4617 9.40363 7.18506 numMergedOcc 0
8 mol 89 unq 0 iso 0 dist 9.55954 6.529 6.53308 6.04996 9.86405 4.46337 numMergedOcc 0
9 mol 92 unq 0 iso 0 dist 6.13521 4.78289 7.06939 4.84869 9.39807 6.61299 numMergedOcc 0
10 mol 98 unq 0 iso 0 dist 5.44426 9.04817 5.10496 11.4327 6.61111 8.70415 numMergedOcc 0
11 mol 98 unq 1 iso 0 dist 5.44426 4.70157 5.92242 11.4327 6.61111 9.74284 numMergedOcc 0
12 mol 98 unq 2 iso 0 dist 5.44426 6.21302 5.2571 11.4327 6.61111 10.0962 numMergedOcc 0
13 mol 98 unq 3 iso 0 dist 5.44426 11.2075 8.7497 11.4327 6.61111 11.2452 numMergedOcc 0
14 mol 98 unq 4 iso 0 dist 8.65429 8.35877 9.64383 13.0095 4.44979 12.0058 numMergedOcc 0
15 mol 98 unq 5 iso 0 dist 8.65429 9.9123 7.54889 13.0095 4.44979 10.0962 numMergedOcc 0
16 mol 98 unq 6 iso 0 dist 8.65429 8.49566 7.78931 13.0095 4.44979 11.2452 numMergedOcc 0
17 mol 115 unq 0 iso 0 dist 9.21978 10.3475 6.39384 5.39389 8.0168 10.7942 numMergedOcc 0
18 mol 115 unq 1 iso 0 dist 9.21978 6.86762 9.42082 5.39389 8.0168 10.9739 numMergedOcc 0
19 mol 115 unq 2 iso 0 dist 9.26505 10.0419 6.24825 5.26498 7.65255 10.2377 numMergedOcc 0
20 mol 133 unq 0 iso 0 dist 7.33743 6.80087 8.77023 12.7763 8.55349 9.53782 numMergedOcc 0
21 mol 134 unq 0 iso 0 dist 9.8564 12.0294 9.33094 8.67365 7.43401 5.3585 numMergedOcc 0
22 mol 134 unq 1 iso 0 dist 9.8564 14.9183 8.69531 8.67365 7.43401 6.74887 numMergedOcc 0
23 mol 181 unq 0 iso 0 dist 7.83476 5.49497 6.64173 12.188 9.09234 6.7991 numMergedOcc 0
24 mol 197 unq 0 iso 0 dist 9.67667 9.73282 9.10817 10.4381 9.27218 5.2908 numMergedOcc 0
25 mol 197 unq 1 iso 0 dist 9.67667 4.74864 6.86828 10.4381 9.27218 6.23998 numMergedOcc 0
26 mol 225 unq 0 iso 0 dist 7.9002 10.0712 8.1945 4.42378 8.91356 10.7506 numMergedOcc 0
27 mol 225 unq 1 iso 0 dist 7.9002 10.0712 8.1945 13.2284 9.59574 7.12954 numMergedOcc 0
28 mol 225 unq 2 iso 0 dist 7.9002 6.7444 6.50998 4.42378 8.91356 8.69249 numMergedOcc 0
29 mol 225 unq 3 iso 0 dist 7.9002 6.7444 6.50998 13.2284 9.59574 14.2819 numMergedOcc 0
30 mol 273 unq 0 iso 0 dist 7.05843 6.95085 6.31969 9.47751 9.06937 7.00883 numMergedOcc 0
31 mol 292 unq 0 iso 0 dist 9.65996 6.39438 9.74118 6.33111 6.1905 5.98906 numMergedOcc 0
32 mol 292 unq 1 iso 0 dist 9.13412 14.0055 9.46442 6.33111 5.84792 12.1551 numMergedOcc 0
