0 mol 11 unq 0 iso 0 dist 9.74528 9.67038 5.47299 17.4352 9.81983 12.6523 numMergedOcc 0
1 mol 17 unq 0 iso 0 dist 8.55161 5.67737 6.64199 16.3739 8.26398 13.5569 numMergedOcc 0
2 mol 17 unq 1 iso 0 dist 8.55161 8.04504 8.90155 16.3739 8.26398 13.9821 numMergedOcc 0
3 mol 28 unq 0 iso 0 dist 8.66738 12.2504 9.28621 10.5901 5.19518 11.6018 numMergedOcc 0
4 mol 28 unq 1 iso 0 dist 8.66738 6.81477 8.94643 10.5901 5.19518 7.07919 numMergedOcc 0
5 mol 28 unq 2 iso 0 dist 8.66738 5.88912 8.36195 10.5901 5.19518 12.4701 numMergedOcc 0
6 mol 54 unq 0 iso 0 dist 6.81735 11.0441 9.24708 5.5226 8.75957 9.14473 numMergedOcc 0
7 mol 63 unq 0 iso 0 dist 6.90923 11.2461 8.9325 11.2228 8.6677 5.59441 numMergedOcc 0
8 mol 79 unq 0 iso 0 dist 7.75543 10.1574 6.64921 12.0977 8.84225 4.39227 numMergedOcc 0
9 mol 79 unq 1 iso 0 dist 7.75543 10.1574 6.64921 8.15741 6.72546 8.32896 numMergedOcc 0
10 mol 85 unq 0 iso 0 dist 8.66427 15.4494 8.60062 6.38363 8.25144 16.5181 numMergedOcc 0
11 mol 85 unq 1 iso 0 dist 8.66427 11.5575 5.16225 6.38363 8.25144 11.9312 numMergedOcc 0
12 mol 85 unq 2 iso 0 dist 7.51319 4.74629 8.67342 16.5205 9.13593 16.5181 numMergedOcc 0
13 mol 85 unq 3 iso 0 dist 7.51319 7.39588 5.73739 16.5205 9.13593 11.9312 numMergedOcc 0
14 mol 85 unq 4 iso 0 dist 8.49887 4.74629 8.60062 16.5205 8.25144 16.5181 numMergedOcc 0
15 mol 85 unq 5 iso 0 dist 8.49887 7.39588 5.16225 16.5205 8.25144 11.9312 numMergedOcc 0
16 mol 85 unq 6 iso 0 dist 9.43839 17.9238 8.67342 6.53627 9.13593 16.5181 numMergedOcc 0
17 mol 85 unq 7 iso 0 dist 9.43839 13.3413 5.73739 6.53627 9.13593 11.9312 numMergedOcc 0
18 mol 87 unq 0 iso 0 dist 6.21471 7.87504 9.20673 6.57984 9.41934 4.99645 numMergedOcc 0
19 mol 157 unq 0 iso 0 dist 7.75542 13.4755 9.46735 5.39036 9.36663 10.4695 numMergedOcc 0
20 mol 182 unq 0 iso 0 dist 6.55146 10.7274 8.7486 12.0639 9.98182 8.99704 numMergedOcc 0
21 mol 182 unq 1 iso 0 dist 6.55146 9.79079 9.06707 12.0639 9.98182 4.49268 numMergedOcc 0
22 mol 254 unq 0 iso 0 dist 9.84028 14.4681 9.83135 10.6769 9.31434 5.80462 numMergedOcc 0
23 mol 286 unq 0 iso 0 dist 8.08382 5.74706 6.89373 8.38969 9.21276 5.70349 numMergedOcc 0
24 mol 287 unq 0 iso 0 dist 8.17436 4.06566 5.55176 13.2009 9.25759 9.62532 numMergedOcc 0
25 mol 288 unq 0 iso 0 dist 8.17436 4.06566 5.55176 13.2009 9.25759 9.62532 numMergedOcc 0
26 mol 289 unq 0 iso 0 dist 8.17436 4.06566 5.55176 13.2009 9.25759 9.62532 numMergedOcc 0
