0 mol 8 unq 0 iso 0 dist 8.80278 8.76702 9.60336 5.95206 8.6405 12.2148 numMergedOcc 0
1 mol 8 unq 1 iso 0 dist 8.80278 6.27477 13.4423 5.95206 8.6405 10.3197 numMergedOcc 0
2 mol 8 unq 2 iso 0 dist 8.73998 8.76702 13.0138 7.55301 5.46588 14.849 numMergedOcc 0
3 mol 8 unq 3 iso 0 dist 8.73998 6.27477 5.95251 7.55301 5.46588 8.99126 numMergedOcc 0
4 mol 25 unq 0 iso 0 dist 8.41008 7.0928 12.4427 8.01293 6.80822 9.43699 numMergedOcc 0
5 mol 59 unq 0 iso 0 dist 5.8166 8.97292 6.34748 11.8719 8.10708 12.4738 numMergedOcc 0
6 mol 59 unq 1 iso 0 dist 5.8166 6.85083 6.47721 11.8719 8.10708 13.882 numMergedOcc 0
7 mol 59 unq 2 iso 0 dist 6.47468 8.97292 13.0793 11.8719 9.20253 12.4738 numMergedOcc 0
8 mol 59 unq 3 iso 0 dist 6.47468 6.85083 8.64013 11.8719 9.20253 13.882 numMergedOcc 0
9 mol 61 unq 0 iso 0 dist 5.97418 8.60577 6.44323 6.35361 9.46217 12.7769 numMergedOcc 0
10 mol 64 unq 0 iso 0 dist 8.91298 8.93949 6.13923 6.32902 8.64746 11.3063 numMergedOcc 0
11 mol 100 unq 0 iso 0 dist 9.52282 5.09688 6.89762 10.6273 6.0026 8.72704 numMergedOcc 0
12 mol 129 unq 0 iso 0 dist 7.48833 8.14071 5.99695 5.09238 7.65371 10.1104 numMergedOcc 0
13 mol 130 unq 0 iso 0 dist 6.5114 9.78456 9.18721 6.47346 6.26422 13.1532 numMergedOcc 0
14 mol 158 unq 0 iso 0 dist 6.45502 8.1504 5.16728 4.64868 8.37022 11.9208 numMergedOcc 0
15 mol 160 unq 0 iso 0 dist 5.13415 9.20228 6.18641 6.78759 9.50008 15.1952 numMergedOcc 0
16 mol 187 unq 0 iso 0 dist 5.26804 7.68247 4.98423 8.40049 6.56642 10.8351 numMergedOcc 0
17 mol 187 unq 1 iso 0 dist 5.26804 7.68247 4.98423 4.8403 7.9625 9.27478 numMergedOcc 0
18 mol 189 unq 0 iso 0 dist 8.81184 9.58744 13.1061 5.79318 7.65477 14.8522 numMergedOcc 0
19 mol 189 unq 1 iso 0 dist 8.81184 9.58744 13.1061 4.88868 8.2926 13.0754 numMergedOcc 0
20 mol 189 unq 2 iso 0 dist 8.81184 9.58744 13.1061 10.78 9.31713 17.702 numMergedOcc 0
21 mol 214 unq 0 iso 0 dist 9.66533 9.01896 11.3575 5.23668 6.96139 12.3623 numMergedOcc 0
22 mol 227 unq 0 iso 0 dist 9.09371 9.93154 5.71921 13.9486 6.20188 10.0384 numMergedOcc 0
23 mol 227 unq 1 iso 0 dist 9.09371 9.93154 5.71921 18.05 9.47836 13.6008 numMergedOcc 0
24 mol 227 unq 2 iso 0 dist 9.09371 9.18218 9.08864 13.9486 6.20188 15.1758 numMergedOcc 0
25 mol 227 unq 3 iso 0 dist 9.09371 9.18218 9.08864 18.05 9.47836 17.3734 numMergedOcc 0
26 mol 227 unq 4 iso 0 dist 9.09371 6.18486 8.98613 13.9486 6.20188 15.0718 numMergedOcc 0
27 mol 227 unq 5 iso 0 dist 9.09371 6.18486 8.98613 18.05 9.47836 17.5607 numMergedOcc 0
28 mol 282 unq 0 iso 0 dist 7.3389 7.70229 13.1327 6.63358 7.10557 10.4802 numMergedOcc 0
29 mol 282 unq 1 iso 0 dist 7.3389 7.90792 11.2762 6.63358 7.10557 7.32347 numMergedOcc 0
30 mol 294 unq 0 iso 0 dist 9.2924 7.1984 6.6414 6.28374 8.05845 9.03492 numMergedOcc 0
