0 mol 28 unq 0 iso 0 dist 8.40467 7.431 8.92334 11.686 5.65052 8.02162 numMergedOcc 0
1 mol 34 unq 0 iso 0 dist 7.50918 6.64208 8.73053 10.5374 5.076 8.65429 numMergedOcc 0
2 mol 34 unq 1 iso 0 dist 9.18907 6.64208 7.07087 10.5374 3.91897 8.65429 numMergedOcc 0
3 mol 43 unq 0 iso 0 dist 7.62469 6.1032 6.57978 13.3446 10.6411 8.93792 numMergedOcc 0
4 mol 73 unq 0 iso 0 dist 6.85356 14.8359 9.66175 16.7273 10.0459 8.14547 numMergedOcc 0
5 mol 73 unq 1 iso 0 dist 7.32265 6.35914 9.66175 6.95094 10.0459 8.14547 numMergedOcc 0
6 mol 81 unq 0 iso 0 dist 9.24998 10.5312 7.02755 15.8503 8.92644 9.61211 numMergedOcc 0
7 mol 90 unq 0 iso 0 dist 7.94379 4.28396 7.01987 8.6308 5.12529 5.28331 numMergedOcc 0
8 mol 101 unq 0 iso 0 dist 9.60223 6.741 8.2549 10.3452 4.84084 8.91685 numMergedOcc 0
9 mol 101 unq 1 iso 0 dist 9.60223 6.741 8.2549 12.68 4.39441 8.83779 numMergedOcc 0
10 mol 101 unq 2 iso 0 dist 7.11476 4.80201 8.2549 5.51185 4.84084 8.91685 numMergedOcc 0
11 mol 101 unq 3 iso 0 dist 7.11476 4.80201 8.2549 9.1109 4.39441 8.83779 numMergedOcc 0
12 mol 120 unq 0 iso 0 dist 8.8894 6.80219 9.13689 11.0753 9.18392 7.78914 numMergedOcc 0
13 mol 120 unq 1 iso 0 dist 8.8894 6.80219 9.13689 14.445 12.4571 9.35938 numMergedOcc 0
14 mol 142 unq 0 iso 0 dist 7.21779 5.19808 6.81144 9.5355 7.46089 5.79144 numMergedOcc 0
15 mol 165 unq 0 iso 0 dist 7.8052 11.4281 8.00005 14.2061 10.5947 4.63353 numMergedOcc 0
16 mol 193 unq 0 iso 0 dist 7.71716 11.2707 9.73679 9.16852 3.53549 6.63784 numMergedOcc 0
17 mol 193 unq 1 iso 0 dist 8.71993 4.40965 9.73679 5.19654 3.53549 6.63784 numMergedOcc 0
18 mol 205 unq 0 iso 0 dist 6.02053 6.20494 4.93303 8.21112 8.82544 9.88692 numMergedOcc 0
19 mol 205 unq 1 iso 0 dist 6.02053 8.39697 9.95859 12.7166 12.6987 6.11886 numMergedOcc 0
20 mol 205 unq 2 iso 0 dist 7.41663 5.10421 4.93303 7.06533 8.82544 9.88692 numMergedOcc 0
21 mol 205 unq 3 iso 0 dist 7.41663 12.776 9.95859 16.9905 12.6987 6.11886 numMergedOcc 0
22 mol 224 unq 0 iso 0 dist 8.96263 6.81831 7.80646 12.0757 5.22231 8.32306 numMergedOcc 0
23 mol 224 unq 1 iso 0 dist 7.35677 6.81831 5.95109 12.0757 5.45067 8.32306 numMergedOcc 0
24 mol 249 unq 0 iso 0 dist 5.70674 5.63037 9.04147 6.04688 4.88298 7.80866 numMergedOcc 0
25 mol 260 unq 0 iso 0 dist 8.13605 8.05498 4.76164 12.6418 5.67613 7.30584 numMergedOcc 0
