0 mol 13 unq 0 iso 0 dist 7.71544 9.44958 10.8881 12.1708 14.604 9.10587 numMergedOcc 0
1 mol 109 unq 0 iso 0 dist 7.59374 7.49224 3.95956 8.81106 8.78681 5.46988 numMergedOcc 0
2 mol 109 unq 1 iso 0 dist 7.59374 7.49224 3.95956 11.6623 11.0452 9.92553 numMergedOcc 0
3 mol 109 unq 2 iso 0 dist 7.59374 8.78681 8.81106 3.95956 7.49224 5.46988 numMergedOcc 0
4 mol 112 unq 0 iso 0 dist 7.84249 7.98999 13.6459 13.0525 20.2655 9.74569 numMergedOcc 0
5 mol 154 unq 0 iso 0 dist 7.10223 9.2042 7.86748 15.6002 16.7964 9.14458 numMergedOcc 0
6 mol 163 unq 0 iso 0 dist 7.7264 9.3832 15.0568 16.5085 21.1922 7.3546 numMergedOcc 0
7 mol 163 unq 1 iso 0 dist 7.5447 6.0247 3.64474 6.56076 5.80513 7.3546 numMergedOcc 0
8 mol 163 unq 2 iso 0 dist 7.5447 5.80513 6.56076 3.64474 6.0247 7.3546 numMergedOcc 0
9 mol 163 unq 3 iso 0 dist 9.04757 5.80513 4.9482 3.64474 11.5745 7.3546 numMergedOcc 0
10 mol 171 unq 0 iso 0 dist 8.59783 7.68295 5.31547 14.0377 10.2264 9.75627 numMergedOcc 0
11 mol 196 unq 0 iso 0 dist 8.86439 7.63142 10.382 11.9939 19.1244 9.83236 numMergedOcc 0
12 mol 218 unq 0 iso 0 dist 8.61427 5.72444 6.57626 5.77167 11.4514 8.93185 numMergedOcc 0
13 mol 218 unq 1 iso 0 dist 8.61427 5.72444 6.57626 7.54799 13.8442 8.22792 numMergedOcc 0
14 mol 237 unq 0 iso 0 dist 9.18638 9.74081 6.08522 12.7987 9.80232 9.84466 numMergedOcc 0
15 mol 237 unq 1 iso 0 dist 9.18638 9.74081 6.08522 5.78318 6.18606 6.16557 numMergedOcc 0
16 mol 237 unq 2 iso 0 dist 9.18638 9.74081 6.08522 10.217 10.6667 5.4813 numMergedOcc 0
17 mol 237 unq 3 iso 0 dist 9.18638 9.80232 12.7987 8.55836 13.2931 7.31113 numMergedOcc 0
18 mol 237 unq 4 iso 0 dist 9.18638 9.80232 12.7987 6.08522 9.74081 9.84466 numMergedOcc 0
19 mol 237 unq 5 iso 0 dist 9.18638 6.18606 5.78318 8.55836 13.2931 8.10263 numMergedOcc 0
20 mol 237 unq 6 iso 0 dist 9.18638 6.18606 5.78318 6.08522 9.74081 6.16557 numMergedOcc 0
21 mol 251 unq 0 iso 0 dist 8.89433 8.38382 9.21735 5.12873 11.0437 8.53757 numMergedOcc 0
22 mol 258 unq 0 iso 0 dist 9.64278 8.78354 5.67781 6.73942 10.7516 6.47194 numMergedOcc 0
23 mol 258 unq 1 iso 0 dist 6.15713 8.15795 6.73942 4.88527 8.78354 6.47194 numMergedOcc 0
24 mol 258 unq 2 iso 0 dist 6.15713 8.78354 4.88527 6.73942 8.15795 6.47194 numMergedOcc 0
25 mol 286 unq 0 iso 0 dist 5.03123 7.3415 6.77784 7.28845 7.77655 5.91064 numMergedOcc 0
26 mol 286 unq 1 iso 0 dist 5.03123 7.77655 7.28845 6.77784 7.3415 5.91064 numMergedOcc 0
