0 mol 16 unq 0 iso 0 dist 8.46837 6.84569 6.43294 11.958 8.33883 10.9143 5.66529 5.77753 6.58035 6.2983 numMergedOcc 0
1 mol 16 unq 1 iso 0 dist 8.46837 6.84569 6.43294 11.958 8.33883 10.9143 6.32814 13.1354 8.41862 16.9205 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 7.84699 6.10011 8.04817 13.4367 6.89722 11.4799 10.0721 6.4154 5.64598 7.41074 numMergedOcc 0
3 mol 73 unq 1 iso 0 dist 7.84699 8.124 5.2774 13.4367 6.89722 6.19304 10.0721 6.4154 4.65521 7.41074 numMergedOcc 0
4 mol 73 unq 2 iso 0 dist 8.40844 6.10011 9.76331 5.33851 9.68526 8.9232 10.0721 9.51458 5.64598 13.4082 numMergedOcc 0
5 mol 73 unq 3 iso 0 dist 8.40844 6.10011 9.76331 13.4367 7.26679 11.4799 10.0721 9.51458 5.64598 7.41074 numMergedOcc 0
6 mol 73 unq 4 iso 0 dist 8.40844 6.10011 9.76331 15.7164 9.30776 16.0453 10.0721 9.51458 5.64598 15.9882 numMergedOcc 0
7 mol 73 unq 5 iso 0 dist 8.40844 8.124 5.44275 5.33851 9.68526 10.2049 10.0721 9.51458 4.65521 13.4082 numMergedOcc 0
8 mol 73 unq 6 iso 0 dist 8.40844 8.124 5.44275 13.4367 7.26679 6.19304 10.0721 9.51458 4.65521 7.41074 numMergedOcc 0
9 mol 73 unq 7 iso 0 dist 8.40844 8.124 5.44275 15.7164 9.30776 11.6369 10.0721 9.51458 4.65521 15.9882 numMergedOcc 0
10 mol 73 unq 8 iso 0 dist 6.99156 6.10011 10.4402 5.33851 9.72442 8.9232 10.0721 10.9127 5.64598 13.4082 numMergedOcc 0
11 mol 73 unq 9 iso 0 dist 6.99156 6.10011 10.4402 16.0086 9.02288 18.5645 10.0721 10.9127 5.64598 16.8983 numMergedOcc 0
12 mol 73 unq 10 iso 0 dist 6.99156 8.124 8.0624 5.33851 9.72442 10.2049 10.0721 10.9127 4.65521 13.4082 numMergedOcc 0
13 mol 73 unq 11 iso 0 dist 6.99156 8.124 8.0624 16.0086 9.02288 14.305 10.0721 10.9127 4.65521 16.8983 numMergedOcc 0
14 mol 92 unq 0 iso 0 dist 4.85152 5.90776 6.82886 11.1785 9.514 12.4557 11.7423 12.7989 7.96555 12.3435 numMergedOcc 0
15 mol 92 unq 1 iso 0 dist 4.85152 5.90776 6.82886 10.9352 7.84888 10.2618 11.7423 12.7989 7.96555 11.145 numMergedOcc 0
16 mol 102 unq 0 iso 0 dist 7.73836 9.84673 6.42572 5.09542 9.01767 7.36792 7.6114 11.9326 9.94856 5.498 numMergedOcc 0
17 mol 117 unq 0 iso 0 dist 8.30003 7.0318 10.4589 5.21051 9.85576 7.90328 5.70073 12.907 6.62561 4.91401 numMergedOcc 0
18 mol 156 unq 0 iso 0 dist 6.67598 9.19499 5.0966 5.66289 7.30021 7.44554 11.9162 11.6317 9.36805 6.29785 numMergedOcc 0
19 mol 156 unq 1 iso 0 dist 8.79185 9.19499 9.07974 5.59399 6.71202 12.0598 11.9162 13.5619 9.36805 15.7866 numMergedOcc 0
20 mol 220 unq 0 iso 0 dist 8.58709 6.21273 4.90657 5.1021 9.8711 9.23153 5.33649 10.4686 6.84247 6.7067 numMergedOcc 0
21 mol 220 unq 1 iso 0 dist 8.58709 6.21273 4.90657 5.1021 9.8711 9.23153 12.5011 10.0817 6.99002 15.9568 numMergedOcc 0
22 mol 222 unq 0 iso 0 dist 7.10689 8.5834 4.28891 5.01062 8.7347 7.54212 4.78647 5.04916 7.18956 7.61682 numMergedOcc 0
23 mol 224 unq 0 iso 0 dist 7.7163 7.07564 5.63485 11.8217 9.34636 8.95269 4.92261 8.60781 6.87664 7.98696 numMergedOcc 0
24 mol 224 unq 1 iso 0 dist 7.7163 7.07564 5.63485 10.8463 9.79616 6.57273 4.92261 8.60781 6.87664 7.12232 numMergedOcc 0
25 mol 224 unq 2 iso 0 dist 9.2 7.07564 4.8786 5.44863 9.29703 5.78342 4.92261 11.0076 6.87664 5.3621 numMergedOcc 0
26 mol 227 unq 0 iso 0 dist 7.99145 7.71761 11.4528 5.841 9.17826 7.55216 10.1071 17.5201 8.83563 11.662 numMergedOcc 0
