0 mol 26 unq 0 iso 0 dist 9.44507 8.43529 6.7142 14.0176 5.45023 7.90721 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 9.27369 5.23054 6.07276 6.73259 5.30297 6.73167 numMergedOcc 0
2 mol 26 unq 2 iso 0 dist 6.17217 6.0606 6.81793 9.46609 5.66783 6.38243 numMergedOcc 0
3 mol 92 unq 0 iso 0 dist 5.59552 5.92795 6.59716 10.3334 8.67827 6.98037 numMergedOcc 0
4 mol 92 unq 1 iso 0 dist 5.59552 10.2656 6.87506 10.3334 8.67827 6.9223 numMergedOcc 0
5 mol 92 unq 2 iso 0 dist 5.59552 10.2656 6.87506 16.1036 13.0818 7.0561 numMergedOcc 0
6 mol 93 unq 0 iso 0 dist 7.4518 3.91263 7.28831 8.42713 14.7862 7.8435 numMergedOcc 0
7 mol 93 unq 1 iso 0 dist 9.1687 3.91263 9.71411 8.42713 9.42916 7.8435 numMergedOcc 0
8 mol 112 unq 0 iso 0 dist 8.23777 3.82552 5.36587 10.8508 8.49846 7.34602 numMergedOcc 0
9 mol 112 unq 1 iso 0 dist 5.42828 3.61827 8.72725 10.7968 15.0784 7.44041 numMergedOcc 0
10 mol 119 unq 0 iso 0 dist 9.34823 5.92411 8.67537 9.15988 14.8901 9.57341 numMergedOcc 0
11 mol 154 unq 0 iso 0 dist 5.60184 5.18463 8.71789 9.2042 13.1849 9.82982 numMergedOcc 0
12 mol 154 unq 1 iso 0 dist 7.08477 5.18463 5.2693 9.2042 11.4511 9.82982 numMergedOcc 0
13 mol 170 unq 0 iso 0 dist 9.53158 10.2179 6.47164 14.5669 7.29587 5.13268 numMergedOcc 0
14 mol 171 unq 0 iso 0 dist 6.21194 9.12839 7.47964 10.2264 11.6944 8.999 numMergedOcc 0
15 mol 195 unq 0 iso 0 dist 8.80931 3.7157 6.22742 9.63146 6.0634 6.34234 numMergedOcc 0
16 mol 195 unq 1 iso 0 dist 8.13947 6.61517 9.24936 12.5586 11.4252 7.87972 numMergedOcc 0
17 mol 225 unq 0 iso 0 dist 9.79381 11.9758 6.94762 14.9604 8.98957 7.8744 numMergedOcc 0
18 mol 225 unq 1 iso 0 dist 8.37379 12.7552 6.94762 14.5569 8.98957 7.8744 numMergedOcc 0
19 mol 236 unq 0 iso 0 dist 8.37813 5.45156 6.15635 9.30828 5.92456 9.14068 numMergedOcc 0
20 mol 236 unq 1 iso 0 dist 9.14116 4.88971 6.15635 13.6144 5.92456 9.14068 numMergedOcc 0
21 mol 260 unq 0 iso 0 dist 5.68717 6.73886 9.31888 10.8653 7.16782 9.50634 numMergedOcc 0
22 mol 267 unq 0 iso 0 dist 9.80577 8.3484 6.27154 13.7004 4.61607 7.60505 numMergedOcc 0
23 mol 273 unq 0 iso 0 dist 9.78826 13.255 5.61969 15.8682 9.76492 5.4307 numMergedOcc 0
