0 mol 8 unq 0 iso 0 dist 9.59644 12.4541 8.4444 14.5238 5.95251 7.8922 numMergedOcc 0
1 mol 8 unq 1 iso 0 dist 6.68091 11.4765 9.95165 15.118 15.9496 6.82379 numMergedOcc 0
2 mol 8 unq 2 iso 0 dist 6.68091 11.4765 9.95165 16.4447 14.678 6.24978 numMergedOcc 0
3 mol 8 unq 3 iso 0 dist 6.68091 11.4765 9.95165 20.5466 17.3707 9.66439 numMergedOcc 0
4 mol 8 unq 4 iso 0 dist 6.68091 11.4765 9.95165 17.0203 12.915 7.3915 numMergedOcc 0
5 mol 33 unq 0 iso 0 dist 8.41842 7.41772 5.2746 12.2459 5.62472 8.00177 numMergedOcc 0
6 mol 51 unq 0 iso 0 dist 8.55004 11.8998 9.42071 16.3476 10.1569 7.76282 numMergedOcc 0
7 mol 85 unq 0 iso 0 dist 7.61312 4.81974 9.924 6.58793 3.85308 7.33422 numMergedOcc 0
8 mol 92 unq 0 iso 0 dist 5.37819 4.98638 5.22996 9.96037 6.09495 6.49956 numMergedOcc 0
9 mol 119 unq 0 iso 0 dist 9.34752 10.6499 8.84146 16.7151 13.7656 7.77116 numMergedOcc 0
10 mol 119 unq 1 iso 0 dist 8.41858 10.2473 8.84146 16.5181 13.7656 7.77116 numMergedOcc 0
11 mol 124 unq 0 iso 0 dist 9.7589 9.18927 4.83761 17.4489 8.39675 8.97264 numMergedOcc 0
12 mol 124 unq 1 iso 0 dist 9.7589 9.18927 4.83761 17.8032 10.3233 8.80896 numMergedOcc 0
13 mol 130 unq 0 iso 0 dist 9.92685 7.19014 4.85559 15.3663 7.09664 8.33077 numMergedOcc 0
14 mol 186 unq 0 iso 0 dist 5.83898 9.4839 5.67811 14.2341 9.13357 7.28841 numMergedOcc 0
15 mol 207 unq 0 iso 0 dist 8.27274 13.7871 9.22778 15.3007 7.53149 8.32218 numMergedOcc 0
16 mol 207 unq 1 iso 0 dist 8.27274 13.7871 9.22778 21.6029 15.6632 7.96797 numMergedOcc 0
17 mol 214 unq 0 iso 0 dist 7.1951 6.83037 8.91471 12.9165 13.193 7.05523 numMergedOcc 0
18 mol 214 unq 1 iso 0 dist 7.1951 6.83037 8.91471 4.84709 3.99247 8.46327 numMergedOcc 0
19 mol 225 unq 0 iso 0 dist 7.47852 7.01029 8.768 10.689 6.89798 6.6561 numMergedOcc 0
20 mol 225 unq 1 iso 0 dist 6.22332 11.2993 8.768 12.2756 6.89798 6.6561 numMergedOcc 0
21 mol 229 unq 0 iso 0 dist 5.75755 7.78418 9.3376 8.6537 12.696 8.92743 numMergedOcc 0
22 mol 229 unq 1 iso 0 dist 5.75755 7.78418 9.3376 10.8071 11.6366 8.08082 numMergedOcc 0
23 mol 229 unq 2 iso 0 dist 5.75755 7.78418 9.3376 5.57702 6.44004 5.77318 numMergedOcc 0
24 mol 229 unq 3 iso 0 dist 5.75755 7.78418 9.3376 13.1488 10.442 8.19603 numMergedOcc 0
25 mol 266 unq 0 iso 0 dist 9.33791 10.7175 9.98606 12.9282 6.01492 7.71657 numMergedOcc 0
26 mol 274 unq 0 iso 0 dist 6.28023 4.85537 9.4626 8.49076 7.23876 7.52109 numMergedOcc 0
27 mol 279 unq 0 iso 0 dist 8.299 12.3159 8.84798 19.3907 13.8061 8.29305 numMergedOcc 0
28 mol 279 unq 1 iso 0 dist 8.299 12.3159 8.84798 13.7309 7.7504 6.43341 numMergedOcc 0
