0 mol 10 unq 0 iso 0 dist 9.6581 5.94028 7.8329 10.8707 9.76721 5.59965 numMergedOcc 0
1 mol 44 unq 0 iso 0 dist 9.78501 6.51988 6.53981 10.6566 8.06674 7.48846 numMergedOcc 0
2 mol 48 unq 0 iso 0 dist 7.87476 6.62574 5.89173 14.5465 12.69 8.29857 numMergedOcc 0
3 mol 48 unq 1 iso 0 dist 9.05694 6.04522 6.28603 9.84045 6.17529 8.29857 numMergedOcc 0
4 mol 48 unq 2 iso 0 dist 8.36323 6.98858 5.72703 14.5966 12.5721 8.19993 numMergedOcc 0
5 mol 48 unq 3 iso 0 dist 8.69081 6.14836 5.73454 9.77237 6.30002 8.19993 numMergedOcc 0
6 mol 92 unq 0 iso 0 dist 9.22123 13.3884 8.43964 16.2497 7.08542 9.60622 numMergedOcc 0
7 mol 102 unq 0 iso 0 dist 9.49592 6.69798 6.07633 14.4245 7.28191 8.88394 numMergedOcc 0
8 mol 102 unq 1 iso 0 dist 5.88034 5.6591 6.07633 11.7662 7.28191 8.88394 numMergedOcc 0
9 mol 141 unq 0 iso 0 dist 9.80185 7.20376 9.59109 11.8903 3.80087 9.83945 numMergedOcc 0
10 mol 141 unq 1 iso 0 dist 9.80185 7.20376 9.59109 7.35385 3.80763 6.75376 numMergedOcc 0
11 mol 141 unq 2 iso 0 dist 9.80185 7.20376 9.59109 8.35864 9.98068 9.10042 numMergedOcc 0
12 mol 186 unq 0 iso 0 dist 7.005 8.03698 5.25762 9.53805 5.39534 6.21159 numMergedOcc 0
13 mol 232 unq 0 iso 0 dist 9.69133 5.39184 9.78273 12.4203 12.3206 9.78181 numMergedOcc 0
14 mol 232 unq 1 iso 0 dist 9.69133 5.39184 9.78273 13.5442 12.159 9.8664 numMergedOcc 0
15 mol 249 unq 0 iso 0 dist 9.38713 10.4369 8.76518 14.9674 11.2713 5.9627 numMergedOcc 0
16 mol 250 unq 0 iso 0 dist 8.54286 12.1185 9.25035 5.99119 4.14699 9.70149 numMergedOcc 0
17 mol 273 unq 0 iso 0 dist 8.5948 5.62662 9.81919 10.6456 9.84575 7.16346 numMergedOcc 0
18 mol 277 unq 0 iso 0 dist 9.48076 5.10104 6.23115 5.92532 12.1127 8.20644 numMergedOcc 0
19 mol 277 unq 1 iso 0 dist 8.04081 12.5127 6.23115 18.7651 12.1127 8.20644 numMergedOcc 0
20 mol 284 unq 0 iso 0 dist 8.2474 13.0509 7.74874 17.8119 9.94624 7.34931 numMergedOcc 0
