0 mol 11 unq 0 iso 0 dist 9.07476 6.65725 4.79838 9.52695 6.76736 8.73067 numMergedOcc 0
1 mol 11 unq 1 iso 0 dist 9.04534 6.35394 5.25331 9.78754 6.51674 9.09091 numMergedOcc 0
2 mol 59 unq 0 iso 0 dist 4.90216 4.07863 7.92479 7.69638 3.68327 9.43355 numMergedOcc 0
3 mol 59 unq 1 iso 0 dist 4.90216 4.07863 7.92479 11.9788 15.3578 7.9327 numMergedOcc 0
4 mol 59 unq 2 iso 0 dist 9.84217 4.07863 7.86646 7.69638 9.13939 9.43355 numMergedOcc 0
5 mol 59 unq 3 iso 0 dist 9.84217 4.07863 7.86646 11.9788 10.3023 7.9327 numMergedOcc 0
6 mol 73 unq 0 iso 0 dist 8.4515 15.9672 7.78587 15.645 7.98468 7.10439 numMergedOcc 0
7 mol 79 unq 0 iso 0 dist 7.06029 11.9573 9.11491 11.9711 5.84075 9.63599 numMergedOcc 0
8 mol 90 unq 0 iso 0 dist 6.10053 4.97513 6.18681 11.4116 5.57394 9.56752 numMergedOcc 0
9 mol 116 unq 0 iso 0 dist 8.50194 4.6158 6.28029 10.2858 4.13755 6.49383 numMergedOcc 0
10 mol 116 unq 1 iso 0 dist 8.24233 5.79458 6.28029 7.6005 4.13755 6.49383 numMergedOcc 0
11 mol 141 unq 0 iso 0 dist 9.48934 4.06022 9.68074 8.30496 8.79381 8.75562 numMergedOcc 0
12 mol 141 unq 1 iso 0 dist 9.48934 4.06022 9.68074 6.78469 5.16197 8.00449 numMergedOcc 0
13 mol 141 unq 2 iso 0 dist 6.41183 6.47962 9.68074 9.5805 8.79381 8.75562 numMergedOcc 0
14 mol 141 unq 3 iso 0 dist 6.41183 6.47962 9.68074 8.01453 5.16197 8.00449 numMergedOcc 0
15 mol 181 unq 0 iso 0 dist 8.17301 4.48609 7.61421 10.9891 13.4378 7.13252 numMergedOcc 0
16 mol 204 unq 0 iso 0 dist 9.12524 5.43506 7.76863 14.3041 9.16458 9.55606 numMergedOcc 0
17 mol 232 unq 0 iso 0 dist 9.67243 6.17401 8.49913 9.41148 9.85068 7.10413 numMergedOcc 0
18 mol 235 unq 0 iso 0 dist 8.1174 5.52698 9.11149 10.8785 6.82702 7.95766 numMergedOcc 0
19 mol 237 unq 0 iso 0 dist 7.69237 8.90537 8.33629 10.1724 4.50383 5.98039 numMergedOcc 0
20 mol 237 unq 1 iso 0 dist 7.69237 8.90537 8.33629 15.6154 9.41259 9.48932 numMergedOcc 0
21 mol 254 unq 0 iso 0 dist 7.89302 5.11145 6.59989 14.055 11.9238 8.94909 numMergedOcc 0
22 mol 265 unq 0 iso 0 dist 5.8898 6.97049 5.94614 10.2019 6.31696 5.40318 numMergedOcc 0
23 mol 274 unq 0 iso 0 dist 9.82713 5.95459 9.85661 6.83113 6.97575 9.20749 numMergedOcc 0
24 mol 287 unq 0 iso 0 dist 9.1471 4.26276 7.77225 7.76945 3.96271 5.59555 numMergedOcc 0
25 mol 287 unq 1 iso 0 dist 7.84189 4.26276 5.50067 7.76945 5.39801 5.59555 numMergedOcc 0
26 mol 288 unq 0 iso 0 dist 9.1471 4.26276 7.77225 7.76945 3.96271 5.59555 numMergedOcc 0
27 mol 288 unq 1 iso 0 dist 7.84189 4.26276 5.50067 7.76945 5.39801 5.59555 numMergedOcc 0
28 mol 289 unq 0 iso 0 dist 9.1471 4.26276 7.77225 7.76945 3.96271 5.59555 numMergedOcc 0
29 mol 289 unq 1 iso 0 dist 7.84189 4.26276 5.50067 7.76945 5.39801 5.59555 numMergedOcc 0
30 mol 294 unq 0 iso 0 dist 9.64969 10.3713 9.33755 16.1781 8.56972 8.87606 numMergedOcc 0
