0 mol 19 unq 0 iso 0 dist 8.40009 6.50749 8.78293 10.5638 5.31524 7.20519 7.89092 9.95011 5.5841 9.80108 numMergedOcc 0
1 mol 19 unq 1 iso 0 dist 8.40009 6.50749 8.78293 13.0647 11.4401 6.864 7.89092 9.95011 5.5841 8.58657 numMergedOcc 0
2 mol 19 unq 2 iso 0 dist 8.97657 11.5539 8.23643 17.3673 11.0832 7.20519 14.7564 13.6944 5.5841 9.80108 numMergedOcc 0
3 mol 19 unq 3 iso 0 dist 8.97657 11.5539 8.23643 17.6819 12.3093 6.864 14.7564 13.6944 5.5841 8.58657 numMergedOcc 0
4 mol 59 unq 0 iso 0 dist 8.62501 5.83686 8.24062 10.5281 5.3525 7.71095 4.50806 6.5096 5.33688 6.71911 numMergedOcc 0
5 mol 88 unq 0 iso 0 dist 9.97598 4.31214 8.66514 12.6459 8.4283 9.36773 10.5019 13.649 6.95868 9.2603 numMergedOcc 0
6 mol 88 unq 1 iso 0 dist 7.44647 9.86323 9.25235 8.71603 5.37521 9.36773 11.6458 12.48 6.95868 9.2603 numMergedOcc 0
7 mol 114 unq 0 iso 0 dist 7.83743 5.61542 8.68821 9.81252 5.33327 7.35754 6.83232 7.36816 4.77056 7.52743 numMergedOcc 0
8 mol 127 unq 0 iso 0 dist 8.50625 10.7122 8.59981 10.8022 14.085 9.30299 6.35116 6.3244 4.77464 9.81878 numMergedOcc 0
9 mol 127 unq 1 iso 0 dist 8.97156 13.0804 9.81878 10.5533 4.77464 9.30299 4.95538 6.3244 14.085 8.59981 numMergedOcc 0
10 mol 127 unq 2 iso 0 dist 8.97156 13.0804 9.81878 10.5533 4.77464 9.30299 13.2934 11.7518 13.1312 7.34519 numMergedOcc 0
11 mol 214 unq 0 iso 0 dist 6.56655 5.4238 7.46831 11.296 6.67959 8.85478 13.1492 11.7443 8.47007 6.97182 numMergedOcc 0
12 mol 214 unq 1 iso 0 dist 6.56655 5.4238 7.46831 11.296 6.67959 8.85478 16.4894 12.7646 12.8334 6.1175 numMergedOcc 0
13 mol 238 unq 0 iso 0 dist 6.21984 6.2683 6.91569 12.1817 10.9761 6.57393 12.3898 11.9092 6.20606 5.38637 numMergedOcc 0
14 mol 239 unq 0 iso 0 dist 7.35524 4.94369 7.20082 10.4143 7.04058 7.00034 5.47616 6.34801 6.26168 7.39747 numMergedOcc 0
15 mol 239 unq 1 iso 0 dist 7.35524 4.94369 7.20082 10.4143 7.04058 7.00034 6.55542 9.95595 5.39146 8.1777 numMergedOcc 0
16 mol 239 unq 2 iso 0 dist 6.88731 6.94683 7.39747 10.9983 6.26168 7.00034 6.59691 6.34801 7.04058 7.20082 numMergedOcc 0
17 mol 248 unq 0 iso 0 dist 8.33529 10.9904 8.50864 11.5956 10.1857 7.69895 14.7373 13.4404 6.48757 6.07192 numMergedOcc 0
18 mol 259 unq 0 iso 0 dist 9.19369 15.9608 8.37865 14.0886 5.31048 5.30224 20.096 11.4462 4.99891 6.77938 numMergedOcc 0
19 mol 259 unq 1 iso 0 dist 9.19369 15.9608 8.37865 14.0886 5.31048 5.30224 17.5507 9.64797 5.32839 7.76676 numMergedOcc 0
