0 mol 11 unq 0 iso 0 dist 9.52695 9.07476 6.76736 6.65725 8.73067 4.79838 numMergedOcc 0
1 mol 11 unq 1 iso 0 dist 9.78754 9.04534 6.51674 6.35394 9.09091 5.25331 numMergedOcc 0
2 mol 59 unq 0 iso 0 dist 7.69638 4.90216 3.68327 4.07863 9.43355 7.92479 numMergedOcc 0
3 mol 59 unq 1 iso 0 dist 7.69638 9.84217 9.13939 4.07863 9.43355 7.86646 numMergedOcc 0
4 mol 78 unq 0 iso 0 dist 9.4486 8.48827 4.35598 10.1263 10.5623 7.03887 numMergedOcc 0
5 mol 78 unq 1 iso 0 dist 9.4486 7.14048 5.50339 10.1263 10.5623 5.36451 numMergedOcc 0
6 mol 116 unq 0 iso 0 dist 7.6005 8.24233 4.13755 5.79458 6.49383 6.28029 numMergedOcc 0
7 mol 141 unq 0 iso 0 dist 8.30496 9.48934 8.79381 4.06022 8.75562 9.68074 numMergedOcc 0
8 mol 141 unq 1 iso 0 dist 6.78469 9.48934 5.16197 4.06022 8.00449 9.68074 numMergedOcc 0
9 mol 141 unq 2 iso 0 dist 8.01453 6.41183 5.16197 6.47962 8.00449 9.68074 numMergedOcc 0
10 mol 147 unq 0 iso 0 dist 9.41073 8.76449 10.1443 4.30798 12.8705 9.23589 numMergedOcc 0
11 mol 147 unq 1 iso 0 dist 9.41073 8.36182 11.2502 4.30798 12.8705 9.22196 numMergedOcc 0
12 mol 232 unq 0 iso 0 dist 9.41148 9.67243 9.85068 6.17401 7.10413 8.49913 numMergedOcc 0
13 mol 232 unq 1 iso 0 dist 7.83422 9.67243 12.3471 6.17401 12.9353 8.49913 numMergedOcc 0
14 mol 260 unq 0 iso 0 dist 5.68717 9.46576 7.28821 14.2669 14.0908 8.8385 numMergedOcc 0
15 mol 270 unq 0 iso 0 dist 8.50042 8.76202 6.72549 7.89426 10.2929 6.13775 numMergedOcc 0
16 mol 274 unq 0 iso 0 dist 9.11072 9.82713 8.87313 5.95459 11.4246 9.85661 numMergedOcc 0
17 mol 274 unq 1 iso 0 dist 6.83113 9.82713 6.97575 5.95459 9.20749 9.85661 numMergedOcc 0
18 mol 274 unq 2 iso 0 dist 9.44134 9.82713 9.92055 5.95459 14.1967 9.85661 numMergedOcc 0
19 mol 287 unq 0 iso 0 dist 7.76945 9.1471 3.96271 4.26276 5.59555 7.77225 numMergedOcc 0
20 mol 287 unq 1 iso 0 dist 7.76945 7.84189 5.39801 4.26276 5.59555 5.50067 numMergedOcc 0
21 mol 288 unq 0 iso 0 dist 7.76945 9.1471 3.96271 4.26276 5.59555 7.77225 numMergedOcc 0
22 mol 288 unq 1 iso 0 dist 7.76945 7.84189 5.39801 4.26276 5.59555 5.50067 numMergedOcc 0
23 mol 289 unq 0 iso 0 dist 7.76945 9.1471 3.96271 4.26276 5.59555 7.77225 numMergedOcc 0
24 mol 289 unq 1 iso 0 dist 7.76945 7.84189 5.39801 4.26276 5.59555 5.50067 numMergedOcc 0
