0 mol 54 unq 0 iso 0 dist 7.51978 7.18148 13.8618 13.9555 7.21717 20.576 numMergedOcc 0
1 mol 91 unq 0 iso 0 dist 7.28711 8.47126 9.80027 9.98867 5.73743 13.4457 numMergedOcc 0
2 mol 143 unq 0 iso 0 dist 8.72463 7.99127 6.75249 16.1752 7.78652 13.6073 numMergedOcc 0
3 mol 143 unq 1 iso 0 dist 8.72463 7.99127 6.75249 17.1567 8.91301 12.9862 numMergedOcc 0
4 mol 143 unq 2 iso 0 dist 6.7319 8.72521 10.9086 8.10288 6.6554 14.803 numMergedOcc 0
5 mol 143 unq 3 iso 0 dist 6.7319 8.19373 7.02542 8.10288 6.6554 10.6831 numMergedOcc 0
6 mol 148 unq 0 iso 0 dist 9.7168 7.91749 6.77599 6.57631 9.99156 8.74878 numMergedOcc 0
7 mol 148 unq 1 iso 0 dist 9.7168 7.91749 6.77599 8.40891 8.18085 10.0716 numMergedOcc 0
8 mol 150 unq 0 iso 0 dist 9.61132 7.96309 6.74495 6.56068 9.8656 8.74018 numMergedOcc 0
9 mol 150 unq 1 iso 0 dist 9.61132 7.96309 6.74495 8.32178 7.94889 10.0288 numMergedOcc 0
10 mol 167 unq 0 iso 0 dist 6.64164 9.5648 12.8624 10.2539 9.67741 18.0601 numMergedOcc 0
11 mol 176 unq 0 iso 0 dist 4.96326 7.02812 5.02061 5.19351 7.33273 11.3115 numMergedOcc 0
12 mol 182 unq 0 iso 0 dist 6.31492 8.43599 11.1685 7.00671 6.73956 15.1576 numMergedOcc 0
13 mol 182 unq 1 iso 0 dist 6.31492 8.43599 11.1685 11.1247 7.09394 17.7169 numMergedOcc 0
14 mol 182 unq 2 iso 0 dist 7.8621 7.01577 6.1548 9.23913 6.73956 11.9309 numMergedOcc 0
15 mol 182 unq 3 iso 0 dist 7.8621 7.01577 6.1548 5.77163 7.09394 9.02127 numMergedOcc 0
16 mol 192 unq 0 iso 0 dist 9.05666 8.42665 12.1342 5.76622 8.77999 10.8072 numMergedOcc 0
17 mol 198 unq 0 iso 0 dist 5.80867 7.48253 4.27652 6.42799 6.34616 8.78623 numMergedOcc 0
18 mol 198 unq 1 iso 0 dist 9.4363 6.13687 4.27652 10.4394 6.34616 8.78623 numMergedOcc 0
19 mol 204 unq 0 iso 0 dist 7.92766 7.8518 6.49075 15.254 9.68728 15.6821 numMergedOcc 0
20 mol 204 unq 1 iso 0 dist 6.32652 7.8518 8.62057 7.65133 9.1458 14.0881 numMergedOcc 0
21 mol 213 unq 0 iso 0 dist 6.82185 7.86605 4.71943 10.6201 7.37798 9.34602 numMergedOcc 0
22 mol 213 unq 1 iso 0 dist 6.82185 7.86605 4.71943 5.50169 7.73322 10.4161 numMergedOcc 0
23 mol 213 unq 2 iso 0 dist 6.82881 7.86605 3.62097 5.50169 8.14332 10.4161 numMergedOcc 0
24 mol 218 unq 0 iso 0 dist 5.52981 8.5458 9.81852 5.3192 6.1951 13.5182 numMergedOcc 0
25 mol 238 unq 0 iso 0 dist 9.29203 9.59909 8.71924 13.6806 7.57812 14.4206 numMergedOcc 0
26 mol 238 unq 1 iso 0 dist 9.29203 9.59909 8.71924 16.2617 8.69104 17.1864 numMergedOcc 0
27 mol 238 unq 2 iso 0 dist 7.80166 9.59909 14.2741 13.6806 9.24557 14.4206 numMergedOcc 0
28 mol 249 unq 0 iso 0 dist 6.42827 6.32658 10.3504 5.74889 5.48118 8.76518 numMergedOcc 0
29 mol 287 unq 0 iso 0 dist 7.28096 6.17759 7.83168 12.4113 6.89451 12.8445 numMergedOcc 0
30 mol 287 unq 1 iso 0 dist 7.28096 8.20391 10.0322 12.4113 6.89451 12.7018 numMergedOcc 0
31 mol 288 unq 0 iso 0 dist 7.28096 6.17759 7.83168 12.4113 6.89451 12.8445 numMergedOcc 0
32 mol 288 unq 1 iso 0 dist 7.28096 8.20391 10.0322 12.4113 6.89451 12.7018 numMergedOcc 0
33 mol 289 unq 0 iso 0 dist 7.28096 6.17759 7.83168 12.4113 6.89451 12.8445 numMergedOcc 0
34 mol 289 unq 1 iso 0 dist 7.28096 8.20391 10.0322 12.4113 6.89451 12.7018 numMergedOcc 0
