0 mol 20 unq 0 iso 0 dist 7.77627 16.0555 9.0017 15.2351 9.47299 8.72342 numMergedOcc 0
1 mol 20 unq 1 iso 0 dist 6.12382 12.1601 9.0017 10.2538 9.47299 8.72342 numMergedOcc 0
2 mol 54 unq 0 iso 0 dist 9.72804 10.9689 6.89022 16.2073 8.89627 8.75957 numMergedOcc 0
3 mol 85 unq 0 iso 0 dist 8.58689 3.93024 8.87977 5.20528 6.64001 6.46549 numMergedOcc 0
4 mol 85 unq 1 iso 0 dist 7.82214 3.93024 9.43843 5.20528 4.58085 6.46549 numMergedOcc 0
5 mol 131 unq 0 iso 0 dist 9.96357 7.75948 9.8911 9.63085 5.06665 7.84546 numMergedOcc 0
6 mol 135 unq 0 iso 0 dist 9.71463 11.3917 7.74087 15.9968 11.7342 7.02963 numMergedOcc 0
7 mol 157 unq 0 iso 0 dist 9.94725 5.56117 5.32542 10.0634 8.07977 9.36663 numMergedOcc 0
8 mol 158 unq 0 iso 0 dist 8.71292 10.6578 9.56702 11.3576 6.03833 7.20362 numMergedOcc 0
9 mol 186 unq 0 iso 0 dist 7.87925 9.15827 9.64977 18.2822 15.9388 9.31569 numMergedOcc 0
10 mol 186 unq 1 iso 0 dist 7.87925 9.15827 9.64977 8.41708 4.04186 8.72743 numMergedOcc 0
11 mol 197 unq 0 iso 0 dist 6.18166 5.15513 9.10527 9.3055 5.47413 9.15715 numMergedOcc 0
12 mol 205 unq 0 iso 0 dist 6.254 12.0078 9.66947 11.3463 6.29383 6.81516 numMergedOcc 0
13 mol 205 unq 1 iso 0 dist 6.254 3.30102 5.69652 6.32542 8.16279 5.59832 numMergedOcc 0
14 mol 205 unq 2 iso 0 dist 6.254 3.30102 5.69652 11.3463 6.29383 9.17562 numMergedOcc 0
15 mol 217 unq 0 iso 0 dist 8.57319 5.14513 9.04156 5.88992 9.12199 8.4493 numMergedOcc 0
16 mol 268 unq 0 iso 0 dist 8.49518 8.09464 8.00345 15.8742 10.1411 9.6128 numMergedOcc 0
