0 mol 34 unq 0 iso 0 dist 8.36524 7.66913 7.86199 4.81606 9.44189 10.6133 numMergedOcc 0
1 mol 43 unq 0 iso 0 dist 6.84521 9.35453 10.7805 6.66818 8.92291 14.2045 numMergedOcc 0
2 mol 43 unq 1 iso 0 dist 8.90024 9.35453 13.5667 6.66818 6.79185 14.2045 numMergedOcc 0
3 mol 43 unq 2 iso 0 dist 6.78532 9.35453 7.42491 6.66818 8.37962 14.2045 numMergedOcc 0
4 mol 85 unq 0 iso 0 dist 9.9795 5.20528 9.29301 9.37751 9.30021 13.05 numMergedOcc 0
5 mol 92 unq 0 iso 0 dist 9.96446 6.15011 8.70803 14.0484 7.48658 9.81484 numMergedOcc 0
6 mol 100 unq 0 iso 0 dist 9.61812 9.58313 4.86592 9.18537 4.5985 5.74152 numMergedOcc 0
7 mol 133 unq 0 iso 0 dist 8.66715 9.29665 17.3196 12.9222 9.64695 19.6143 numMergedOcc 0
8 mol 133 unq 1 iso 0 dist 9.00172 9.29665 16.1302 12.9222 4.51266 19.6143 numMergedOcc 0
9 mol 154 unq 0 iso 0 dist 6.44195 8.85675 10.0639 6.31686 7.74216 14.2061 numMergedOcc 0
10 mol 186 unq 0 iso 0 dist 9.52413 8.34668 15.1778 11.6031 8.64379 18.4535 numMergedOcc 0
11 mol 186 unq 1 iso 0 dist 9.52413 8.76308 8.14815 11.6031 8.64379 15.4016 numMergedOcc 0
12 mol 197 unq 0 iso 0 dist 7.70631 9.3055 7.16732 15.4811 8.02386 12.3362 numMergedOcc 0
13 mol 197 unq 1 iso 0 dist 7.70631 9.3055 7.16732 7.35039 6.6259 12.1429 numMergedOcc 0
14 mol 274 unq 0 iso 0 dist 9.13226 6.74022 5.29529 5.04646 6.92434 5.0002 numMergedOcc 0
15 mol 274 unq 1 iso 0 dist 9.13226 6.74022 5.29529 13.7104 6.93875 11.9154 numMergedOcc 0
16 mol 274 unq 2 iso 0 dist 9.13226 6.74022 5.29529 15.0989 6.0868 10.6062 numMergedOcc 0
17 mol 274 unq 3 iso 0 dist 9.13226 6.74022 5.29529 14.8539 6.32856 9.1028 numMergedOcc 0
18 mol 277 unq 0 iso 0 dist 9.38793 7.64361 16.4697 5.45485 9.78482 10.9446 numMergedOcc 0
19 mol 284 unq 0 iso 0 dist 7.43241 6.53769 4.50325 11.0973 8.06073 11.7113 numMergedOcc 0
