0 mol 10 unq 0 iso 0 dist 6.50444 9.87224 7.74463 3.5691 6.77807 11.1641 numMergedOcc 0
1 mol 28 unq 0 iso 0 dist 9.3223 11.7565 7.2551 5.35996 9.2146 13.6047 numMergedOcc 0
2 mol 48 unq 0 iso 0 dist 5.41774 9.90363 7.78899 3.60325 8.29196 10.1404 numMergedOcc 0
3 mol 53 unq 0 iso 0 dist 5.40748 8.86892 8.79235 10.3937 9.32314 14.8207 numMergedOcc 0
4 mol 59 unq 0 iso 0 dist 9.01601 5.09229 7.80026 12.2062 6.23509 12.2403 numMergedOcc 0
5 mol 76 unq 0 iso 0 dist 6.63973 7.7047 6.14248 9.68005 5.45099 5.50078 numMergedOcc 0
6 mol 76 unq 1 iso 0 dist 6.63973 7.7047 6.14248 14.6547 8.44765 11.6055 numMergedOcc 0
7 mol 76 unq 2 iso 0 dist 6.63973 7.7047 6.14248 14.1202 9.06643 13.5729 numMergedOcc 0
8 mol 76 unq 3 iso 0 dist 6.63973 4.00834 6.97936 9.68005 5.45099 11.6853 numMergedOcc 0
9 mol 76 unq 4 iso 0 dist 6.63973 4.00834 6.97936 14.6547 8.44765 15.0489 numMergedOcc 0
10 mol 76 unq 5 iso 0 dist 6.63973 4.00834 6.97936 14.1202 9.06643 14.2393 numMergedOcc 0
11 mol 76 unq 6 iso 0 dist 6.63973 9.6911 5.00466 9.68005 5.45099 4.94673 numMergedOcc 0
12 mol 76 unq 7 iso 0 dist 6.63973 9.6911 5.00466 14.6547 8.44765 5.78236 numMergedOcc 0
13 mol 76 unq 8 iso 0 dist 6.63973 9.6911 5.00466 14.1202 9.06643 4.73151 numMergedOcc 0
14 mol 98 unq 0 iso 0 dist 7.34638 12.2811 6.84952 13.4072 7.14813 4.52783 numMergedOcc 0
15 mol 98 unq 1 iso 0 dist 6.0995 12.1911 6.84952 13.2035 7.14813 4.52783 numMergedOcc 0
16 mol 139 unq 0 iso 0 dist 7.02063 5.61614 6.79625 3.57097 8.83962 5.4082 numMergedOcc 0
17 mol 139 unq 1 iso 0 dist 7.02063 4.94393 7.20542 3.57097 8.83962 7.77973 numMergedOcc 0
18 mol 168 unq 0 iso 0 dist 9.23064 5.27162 7.96541 7.13766 7.0961 9.69599 numMergedOcc 0
19 mol 168 unq 1 iso 0 dist 9.23064 5.27162 7.96541 7.29489 8.26768 7.91845 numMergedOcc 0
20 mol 171 unq 0 iso 0 dist 6.51523 5.24208 9.67711 11.244 9.68512 14.9311 numMergedOcc 0
21 mol 192 unq 0 iso 0 dist 7.93715 8.19854 5.08603 9.20742 8.23162 5.27339 numMergedOcc 0
22 mol 192 unq 1 iso 0 dist 7.93715 4.65303 5.77035 9.20742 8.23162 5.54406 numMergedOcc 0
23 mol 193 unq 0 iso 0 dist 7.85801 5.60329 8.44337 11.9413 6.94187 14.2741 numMergedOcc 0
24 mol 266 unq 0 iso 0 dist 6.22195 6.31111 4.93584 9.9168 9.83672 6.91113 numMergedOcc 0
25 mol 266 unq 1 iso 0 dist 6.22195 5.57126 5.60245 9.9168 9.83672 11.2811 numMergedOcc 0
26 mol 282 unq 0 iso 0 dist 7.60738 4.22263 6.00439 3.81283 9.06947 5.17343 numMergedOcc 0
27 mol 285 unq 0 iso 0 dist 5.09181 6.37482 6.24134 5.00843 7.73438 4.57431 numMergedOcc 0
