0 mol 1 unq 0 iso 0 dist 8.40848 8.27735 6.35409 12.1307 7.81034 13.5574 numMergedOcc 0
1 mol 1 unq 1 iso 0 dist 8.40848 8.27735 6.35409 10.559 9.19497 14.3713 numMergedOcc 0
2 mol 43 unq 0 iso 0 dist 8.60396 8.99509 14.9742 11.3388 9.76585 12.7352 numMergedOcc 0
3 mol 43 unq 1 iso 0 dist 8.60396 8.47617 12.7554 11.3388 9.76585 8.03754 numMergedOcc 0
4 mol 43 unq 2 iso 0 dist 8.60396 5.73331 9.56289 11.3388 9.76585 10.5813 numMergedOcc 0
5 mol 43 unq 3 iso 0 dist 8.60396 8.48694 6.44102 11.3388 9.76585 10.8281 numMergedOcc 0
6 mol 43 unq 4 iso 0 dist 7.48969 6.6657 5.16403 14.9002 9.76585 14.9221 numMergedOcc 0
7 mol 55 unq 0 iso 0 dist 7.03751 7.74108 5.39888 4.42326 8.95571 8.02261 numMergedOcc 0
8 mol 79 unq 0 iso 0 dist 9.04935 7.79726 12.1055 4.82573 5.55798 10.1201 numMergedOcc 0
9 mol 115 unq 0 iso 0 dist 8.21127 5.11612 6.75472 5.73904 5.73946 7.9258 numMergedOcc 0
10 mol 132 unq 0 iso 0 dist 7.64207 7.84864 9.11596 4.8602 8.72039 12.4587 numMergedOcc 0
11 mol 133 unq 0 iso 0 dist 9.86691 9.05674 4.84607 8.09812 6.9268 9.64659 numMergedOcc 0
12 mol 133 unq 1 iso 0 dist 5.59311 8.94909 14.4095 6.14253 9.56319 9.47554 numMergedOcc 0
13 mol 133 unq 2 iso 0 dist 5.59311 8.94909 14.4095 4.88407 6.65267 11.7499 numMergedOcc 0
14 mol 133 unq 3 iso 0 dist 5.7232 8.94909 5.37072 6.14253 9.73038 9.47554 numMergedOcc 0
15 mol 173 unq 0 iso 0 dist 7.76856 9.09857 10.6484 6.2739 6.60418 12.2409 numMergedOcc 0
16 mol 181 unq 0 iso 0 dist 8.94464 9.50454 9.32503 8.18671 6.60648 13.3327 numMergedOcc 0
17 mol 181 unq 1 iso 0 dist 8.94464 7.15963 13.2985 8.18671 6.60648 10.6064 numMergedOcc 0
18 mol 181 unq 2 iso 0 dist 5.93515 6.43406 4.3226 6.35731 5.13534 7.7544 numMergedOcc 0
19 mol 185 unq 0 iso 0 dist 7.5578 6.62848 6.14586 3.55732 8.83768 5.03193 numMergedOcc 0
20 mol 185 unq 1 iso 0 dist 6.06763 6.62848 4.53126 9.15037 8.85182 12.942 numMergedOcc 0
21 mol 185 unq 2 iso 0 dist 6.06763 6.62848 4.53126 3.55732 5.7065 5.03193 numMergedOcc 0
22 mol 236 unq 0 iso 0 dist 4.43243 5.99137 4.15973 7.15062 9.51001 7.87233 numMergedOcc 0
23 mol 259 unq 0 iso 0 dist 6.83706 8.69345 10.7398 14.6808 8.93518 19.0245 numMergedOcc 0
24 mol 265 unq 0 iso 0 dist 8.09021 6.78702 5.75478 15.4423 9.94957 15.5997 numMergedOcc 0
25 mol 265 unq 1 iso 0 dist 6.98451 8.59825 5.75478 11.3503 9.94957 15.5997 numMergedOcc 0
26 mol 265 unq 2 iso 0 dist 6.98451 7.83102 9.74462 11.3503 9.94957 14.5863 numMergedOcc 0
