0 mol 11 unq 0 iso 0 dist 6.40513 5.9863 4.61088 12.8569 8.68293 7.28643 numMergedOcc 0
1 mol 11 unq 1 iso 0 dist 6.40513 5.9863 4.61088 5.83448 6.84216 9.68636 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 6.85331 9.20254 6.86014 7.12984 7.49157 8.66248 numMergedOcc 0
3 mol 24 unq 1 iso 0 dist 6.85331 9.20254 6.86014 5.31288 7.73794 6.73521 numMergedOcc 0
4 mol 24 unq 2 iso 0 dist 6.35095 5.76725 5.54419 6.85946 8.23075 6.7846 numMergedOcc 0
5 mol 24 unq 3 iso 0 dist 6.35095 5.76725 5.54419 6.85662 4.7841 8.03955 numMergedOcc 0
6 mol 34 unq 0 iso 0 dist 6.85305 4.70723 9.24927 16.2037 9.99939 19.1023 numMergedOcc 0
7 mol 75 unq 0 iso 0 dist 7.16583 6.77761 7.79912 4.79348 9.16597 4.74027 numMergedOcc 0
8 mol 75 unq 1 iso 0 dist 7.118 5.06305 7.79912 4.79489 9.16597 4.74027 numMergedOcc 0
9 mol 102 unq 0 iso 0 dist 9.0361 7.49575 7.36792 6.04036 5.54256 3.48119 numMergedOcc 0
10 mol 132 unq 0 iso 0 dist 6.2403 6.04014 7.7059 7.87387 5.77186 6.85721 numMergedOcc 0
11 mol 132 unq 1 iso 0 dist 6.495 10.0823 7.7059 6.53135 5.77186 6.85721 numMergedOcc 0
12 mol 143 unq 0 iso 0 dist 5.30872 6.3915 5.99315 7.33175 8.64905 6.75249 numMergedOcc 0
13 mol 143 unq 1 iso 0 dist 7.5984 5.11989 5.99315 5.08025 8.99891 9.14188 numMergedOcc 0
14 mol 167 unq 0 iso 0 dist 7.83781 6.43506 9.87651 8.2701 5.36671 12.8624 numMergedOcc 0
15 mol 206 unq 0 iso 0 dist 7.10166 5.15743 8.02137 8.44261 6.23183 8.20841 numMergedOcc 0
16 mol 206 unq 1 iso 0 dist 7.10166 13.609 9.774 8.44261 6.23183 7.83734 numMergedOcc 0
17 mol 206 unq 2 iso 0 dist 8.73396 6.35321 7.7366 6.30581 4.51255 7.83734 numMergedOcc 0
18 mol 206 unq 3 iso 0 dist 9.66896 15.7773 8.02137 13.8891 6.23183 8.20841 numMergedOcc 0
19 mol 206 unq 4 iso 0 dist 9.66896 12.0196 9.774 13.8891 6.23183 7.83734 numMergedOcc 0
20 mol 210 unq 0 iso 0 dist 6.53736 11.5481 6.18308 10.061 6.85824 4.29623 numMergedOcc 0
21 mol 210 unq 1 iso 0 dist 8.18851 8.72811 6.18308 5.11839 6.85824 4.29623 numMergedOcc 0
22 mol 222 unq 0 iso 0 dist 8.69148 6.52189 8.01589 7.53235 5.1609 6.91863 numMergedOcc 0
23 mol 222 unq 1 iso 0 dist 8.69148 5.33282 7.7699 7.53235 5.1609 8.26703 numMergedOcc 0
24 mol 222 unq 2 iso 0 dist 8.69148 9.97859 7.21333 7.53235 5.1609 8.89157 numMergedOcc 0
25 mol 231 unq 0 iso 0 dist 9.98232 10.9863 7.37839 13.2586 9.9868 16.456 numMergedOcc 0
26 mol 231 unq 1 iso 0 dist 9.98232 10.9863 7.37839 12.8691 7.3268 6.63423 numMergedOcc 0
27 mol 231 unq 2 iso 0 dist 9.98232 10.2117 8.40182 13.2586 9.9868 17.7601 numMergedOcc 0
28 mol 231 unq 3 iso 0 dist 9.98232 10.2117 8.40182 12.8691 7.3268 10.3815 numMergedOcc 0
29 mol 232 unq 0 iso 0 dist 7.47238 10.134 8.27212 6.89215 8.25985 4.04428 numMergedOcc 0
30 mol 232 unq 1 iso 0 dist 7.47238 10.134 8.27212 11.652 9.27788 4.22149 numMergedOcc 0
31 mol 248 unq 0 iso 0 dist 6.44967 9.48478 7.69895 8.32249 7.79063 6.19721 numMergedOcc 0
32 mol 256 unq 0 iso 0 dist 8.43264 6.19628 8.29103 5.24147 4.80903 5.08421 numMergedOcc 0
33 mol 261 unq 0 iso 0 dist 8.50313 13.3163 8.45658 4.0136 8.24356 11.4108 numMergedOcc 0
34 mol 261 unq 1 iso 0 dist 7.6414 13.6041 8.45658 4.30068 8.24356 11.4108 numMergedOcc 0
35 mol 277 unq 0 iso 0 dist 8.35794 5.77904 9.7748 5.11865 5.69112 7.75371 numMergedOcc 0
36 mol 277 unq 1 iso 0 dist 8.35794 5.77904 9.7748 8.46455 7.2091 11.3546 numMergedOcc 0
37 mol 280 unq 0 iso 0 dist 8.27417 12.0417 6.53701 5.97356 6.01897 6.87492 numMergedOcc 0
38 mol 280 unq 1 iso 0 dist 8.27417 7.26698 6.0664 5.97356 6.01897 3.51781 numMergedOcc 0
