0 mol 34 unq 0 iso 0 dist 8.36524 7.66913 7.86199 5.39587 4.55481 9.12176 10.0272 7.18022 12.8273 7.01952 numMergedOcc 0
1 mol 34 unq 1 iso 0 dist 8.36524 7.66913 7.86199 5.39587 4.55481 9.12176 6.65242 6.24711 10.5579 4.58552 numMergedOcc 0
2 mol 68 unq 0 iso 0 dist 5.9651 8.44761 10.0743 6.09085 7.50975 5.75753 10.6564 12.0495 10.3955 5.7369 numMergedOcc 0
3 mol 68 unq 1 iso 0 dist 5.9651 6.81124 6.20057 6.09085 7.50975 5.26311 10.6564 12.0495 10.7831 5.7369 numMergedOcc 0
4 mol 109 unq 0 iso 0 dist 6.43255 9.88541 9.29894 8.00085 5.00433 5.79394 7.83378 7.07971 14.1491 9.09348 numMergedOcc 0
5 mol 134 unq 0 iso 0 dist 9.42271 6.08299 5.71679 6.14652 12.3479 6.93712 11.6261 11.988 9.0176 8.62504 numMergedOcc 0
6 mol 162 unq 0 iso 0 dist 5.21803 8.27017 5.8736 9.71155 5.65603 10.518 4.6728 7.37333 12.2437 9.43904 numMergedOcc 0
7 mol 162 unq 1 iso 0 dist 5.21803 8.27017 5.8736 9.71155 5.65603 10.518 7.06734 7.45998 13.1079 7.01095 numMergedOcc 0
8 mol 186 unq 0 iso 0 dist 9.52413 8.34668 15.1778 8.9388 15.4336 4.03697 4.68208 11.3216 9.99396 8.5672 numMergedOcc 0
9 mol 186 unq 1 iso 0 dist 9.52413 8.76308 8.14815 8.9388 15.4336 14.8715 4.68208 11.3216 13.0968 8.5672 numMergedOcc 0
10 mol 186 unq 2 iso 0 dist 6.0639 6.0685 7.94756 8.95209 11.6282 3.87082 13.1688 18.0351 11.2869 8.36129 numMergedOcc 0
11 mol 186 unq 3 iso 0 dist 6.0639 6.0685 7.94756 8.95209 11.6282 3.87082 12.4508 16.7149 9.1853 5.86483 numMergedOcc 0
12 mol 186 unq 4 iso 0 dist 6.91355 6.0685 7.02735 8.95209 10.5033 3.87082 13.1688 16.8253 11.2869 8.36129 numMergedOcc 0
13 mol 186 unq 5 iso 0 dist 6.91355 6.0685 7.02735 8.95209 10.5033 3.87082 12.4508 14.7748 9.1853 5.86483 numMergedOcc 0
14 mol 214 unq 0 iso 0 dist 9.43611 6.90717 7.8472 5.56977 8.48942 3.91276 10.4985 16.9119 12.9546 9.43017 numMergedOcc 0
15 mol 217 unq 0 iso 0 dist 7.58097 5.88992 4.92696 8.28155 13.7271 9.98266 12.1239 19.2421 16.9806 9.37602 numMergedOcc 0
16 mol 217 unq 1 iso 0 dist 7.58097 5.88992 4.92696 8.28155 13.7271 9.98266 9.1242 16.3557 12.9961 8.26522 numMergedOcc 0
17 mol 236 unq 0 iso 0 dist 8.95071 5.27184 9.52712 5.9625 10.5937 3.86189 4.51728 10.0129 6.15635 8.93212 numMergedOcc 0
18 mol 236 unq 1 iso 0 dist 8.95071 7.98527 9.82639 5.9625 10.5937 5.69926 4.51728 10.0129 12.1535 8.93212 numMergedOcc 0
19 mol 277 unq 0 iso 0 dist 7.151 6.71956 6.28695 9.22453 11.2997 6.64795 10.3171 9.57499 9.26157 7.16209 numMergedOcc 0
20 mol 277 unq 1 iso 0 dist 7.151 6.71956 6.28695 9.22453 11.2997 6.64795 10.6814 11.4389 9.11117 4.62936 numMergedOcc 0
21 mol 277 unq 2 iso 0 dist 8.53324 6.71956 4.37645 9.22453 4.40029 6.64795 10.3171 5.46926 9.26157 7.16209 numMergedOcc 0
22 mol 277 unq 3 iso 0 dist 8.53324 6.71956 4.37645 9.22453 4.40029 6.64795 10.6814 5.13913 9.11117 4.62936 numMergedOcc 0
23 mol 277 unq 4 iso 0 dist 7.23956 6.71956 7.70529 9.22453 3.97543 6.64795 10.3171 8.9682 9.26157 7.16209 numMergedOcc 0
24 mol 277 unq 5 iso 0 dist 7.23956 6.71956 7.70529 9.22453 3.97543 6.64795 10.6814 6.92711 9.11117 4.62936 numMergedOcc 0
