0 mol 5 unq 0 iso 0 dist 9.13355 7.88567 9.50135 4.8206 11.0809 8.19185 numMergedOcc 0
1 mol 10 unq 0 iso 0 dist 6.47443 8.98746 4.68389 8.65597 9.06457 6.68744 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 9.56639 9.89914 11.3766 5.90358 10.2705 8.00784 numMergedOcc 0
3 mol 36 unq 0 iso 0 dist 9.55519 7.90158 7.69482 11.1913 16.9264 9.96441 numMergedOcc 0
4 mol 48 unq 0 iso 0 dist 9.15275 7.32699 3.5956 14.0438 12.3186 9.77004 numMergedOcc 0
5 mol 48 unq 1 iso 0 dist 9.35075 6.45933 4.48872 10.6879 9.9555 9.77004 numMergedOcc 0
6 mol 48 unq 2 iso 0 dist 9.7772 6.45933 3.5956 10.6879 12.3186 9.77004 numMergedOcc 0
7 mol 48 unq 3 iso 0 dist 7.39468 7.05964 4.91531 6.21973 9.07969 9.54119 numMergedOcc 0
8 mol 48 unq 4 iso 0 dist 5.55714 7.05964 4.38297 6.21973 9.61448 9.54119 numMergedOcc 0
9 mol 48 unq 5 iso 0 dist 9.85287 7.05964 3.63523 6.21973 12.4065 9.54119 numMergedOcc 0
10 mol 48 unq 6 iso 0 dist 9.72232 9.90758 3.63523 17.4974 12.4065 9.54119 numMergedOcc 0
11 mol 72 unq 0 iso 0 dist 9.26417 5.19407 5.36604 4.96022 13.917 9.58357 numMergedOcc 0
12 mol 79 unq 0 iso 0 dist 6.63733 4.5892 3.07021 10.9746 10.5934 9.82679 numMergedOcc 0
13 mol 135 unq 0 iso 0 dist 7.29835 6.63808 4.98191 9.02512 12.7052 8.78439 numMergedOcc 0
14 mol 135 unq 1 iso 0 dist 8.08732 6.63808 5.83178 9.02512 11.5869 8.78439 numMergedOcc 0
15 mol 184 unq 0 iso 0 dist 9.07247 7.72354 9.71065 11.1787 13.5706 9.1526 numMergedOcc 0
16 mol 207 unq 0 iso 0 dist 9.3 7.18945 5.7657 5.32879 13.7709 9.98643 numMergedOcc 0
17 mol 207 unq 1 iso 0 dist 8.61191 7.10149 3.82499 4.09428 10.0478 9.98643 numMergedOcc 0
18 mol 207 unq 2 iso 0 dist 6.76443 7.18945 3.82499 5.32879 10.0478 9.98643 numMergedOcc 0
19 mol 207 unq 3 iso 0 dist 9.62891 7.10149 3.19591 4.09428 12.6945 9.98643 numMergedOcc 0
20 mol 207 unq 4 iso 0 dist 9.14701 7.18945 3.19591 5.32879 12.6945 9.98643 numMergedOcc 0
21 mol 231 unq 0 iso 0 dist 9.33363 8.8788 3.1231 9.61009 10.8379 8.27156 numMergedOcc 0
22 mol 239 unq 0 iso 0 dist 8.03092 7.14918 3.13463 8.65126 8.9327 7.01673 numMergedOcc 0
23 mol 276 unq 0 iso 0 dist 8.51449 9.33041 3.50268 7.93109 7.11952 9.08396 numMergedOcc 0
24 mol 283 unq 0 iso 0 dist 5.63358 6.69403 6.18318 4.49194 4.86946 9.14721 numMergedOcc 0
25 mol 283 unq 1 iso 0 dist 5.63358 5.76694 3.34167 4.49194 4.86946 7.15322 numMergedOcc 0
26 mol 283 unq 2 iso 0 dist 8.39635 9.33601 3.12129 5.2842 9.60873 8.91437 numMergedOcc 0
