0 mol 4 unq 0 iso 0 dist 8.15534 12.7614 8.67981 5.12159 6.12485 11.5212 7.58769 6.21697 14.676 6.86951 numMergedOcc 0
1 mol 12 unq 0 iso 0 dist 7.68446 13.0936 7.44542 13.7296 8.15864 4.60834 16.9813 10.1259 4.62913 6.6051 numMergedOcc 0
2 mol 29 unq 0 iso 0 dist 9.27422 8.33913 6.73481 8.44709 7.50258 9.50033 12.6954 7.34641 12.0262 5.36278 numMergedOcc 0
3 mol 87 unq 0 iso 0 dist 8.21588 6.02518 6.97882 5.34066 5.62336 6.27329 6.62798 5.38943 9.4868 5.63748 numMergedOcc 0
4 mol 87 unq 1 iso 0 dist 8.21588 13.04 7.7858 5.34066 5.62336 7.88443 6.62798 5.38943 10.847 5.63748 numMergedOcc 0
5 mol 87 unq 2 iso 0 dist 6.62798 6.02518 9.4868 10.7803 9.90256 15.7737 11.2078 6.69898 15.7638 7.57471 numMergedOcc 0
6 mol 87 unq 3 iso 0 dist 6.62798 6.02518 9.4868 5.34066 5.63748 6.27329 8.21588 5.38943 6.97882 5.62336 numMergedOcc 0
7 mol 87 unq 4 iso 0 dist 8.15104 8.93266 6.97882 5.22028 5.62336 6.27329 9.94718 5.38943 9.4868 5.63748 numMergedOcc 0
8 mol 87 unq 5 iso 0 dist 8.15104 4.33498 7.7858 5.22028 5.62336 7.88443 9.94718 5.38943 10.847 5.63748 numMergedOcc 0
9 mol 87 unq 6 iso 0 dist 9.94718 8.93266 9.4868 13.2349 9.90256 15.7737 14.8798 6.69898 15.7638 7.57471 numMergedOcc 0
10 mol 87 unq 7 iso 0 dist 9.94718 8.93266 9.4868 5.22028 5.63748 6.27329 8.15104 5.38943 6.97882 5.62336 numMergedOcc 0
11 mol 103 unq 0 iso 0 dist 5.8915 5.18043 7.52954 5.29804 8.078 6.38538 7.95136 6.73664 11.6041 7.66418 numMergedOcc 0
12 mol 133 unq 0 iso 0 dist 7.47105 7.0088 7.17051 11.193 9.2759 5.9683 16.1349 12.1681 9.96416 5.79195 numMergedOcc 0
13 mol 133 unq 1 iso 0 dist 7.47105 7.0088 7.17051 11.193 9.2759 5.9683 12.4593 11.2107 5.9962 8.76088 numMergedOcc 0
14 mol 139 unq 0 iso 0 dist 7.83417 4.71927 5.77343 7.11333 8.78382 4.19005 10.7751 9.781 10.5546 9.70154 numMergedOcc 0
15 mol 204 unq 0 iso 0 dist 6.58174 10.0944 8.40718 10.9794 6.20044 12.4189 15.0667 8.63339 12.2846 6.62514 numMergedOcc 0
16 mol 204 unq 1 iso 0 dist 6.58174 10.0944 8.40718 10.9794 6.20044 12.4189 16.9923 11.09 17.6118 9.41996 numMergedOcc 0
17 mol 236 unq 0 iso 0 dist 5.46484 5.05085 5.6568 5.81446 7.74348 4.24722 14.2393 15.386 12.2537 8.63249 numMergedOcc 0
18 mol 236 unq 1 iso 0 dist 8.80671 10.8749 5.6568 14.8289 7.74348 4.24722 22.3246 15.386 12.2537 8.63249 numMergedOcc 0
19 mol 266 unq 0 iso 0 dist 9.46926 5.43882 9.33791 4.95934 8.8646 8.55958 7.72433 6.70676 10.8595 7.9555 numMergedOcc 0
20 mol 287 unq 0 iso 0 dist 4.98604 4.91435 7.47179 5.51191 6.45597 6.53276 10.1896 5.69849 10.6184 9.18785 numMergedOcc 0
21 mol 288 unq 0 iso 0 dist 4.98604 4.91435 7.47179 5.51191 6.45597 6.53276 10.1896 5.69849 10.6184 9.18785 numMergedOcc 0
22 mol 289 unq 0 iso 0 dist 4.98604 4.91435 7.47179 5.51191 6.45597 6.53276 10.1896 5.69849 10.6184 9.18785 numMergedOcc 0
