0 mol 4 unq 0 iso 0 dist 9.4539 7.2062 4.59439 6.97734 3.9877 5.88145 numMergedOcc 0
1 mol 4 unq 1 iso 0 dist 6.47964 7.2062 9.18299 6.97734 12.1304 5.88145 numMergedOcc 0
2 mol 4 unq 2 iso 0 dist 9.50144 7.2062 14.0083 6.97734 15.8209 5.88145 numMergedOcc 0
3 mol 13 unq 0 iso 0 dist 8.12105 9.26072 8.96055 9.62521 3.43881 7.57973 numMergedOcc 0
4 mol 24 unq 0 iso 0 dist 5.85737 9.21068 9.47657 8.11143 4.19221 8.31805 numMergedOcc 0
5 mol 24 unq 1 iso 0 dist 5.85737 9.21068 9.47657 8.9776 8.0288 3.30351 numMergedOcc 0
6 mol 30 unq 0 iso 0 dist 8.204 7.75449 6.73037 7.88072 3.90342 3.30907 numMergedOcc 0
7 mol 33 unq 0 iso 0 dist 8.04019 7.03174 11.7029 6.53195 7.85245 9.70861 numMergedOcc 0
8 mol 33 unq 1 iso 0 dist 7.44828 7.03174 5.34698 6.53195 11.1555 9.70861 numMergedOcc 0
9 mol 62 unq 0 iso 0 dist 9.11512 8.22018 12.8904 7.61377 3.90956 9.23222 numMergedOcc 0
10 mol 62 unq 1 iso 0 dist 9.11512 8.31737 14.1477 7.61377 3.90956 13.7476 numMergedOcc 0
11 mol 63 unq 0 iso 0 dist 6.49343 7.87739 11.0084 7.85738 12.6017 5.98039 numMergedOcc 0
12 mol 78 unq 0 iso 0 dist 6.54194 7.65495 4.50796 9.93747 6.87984 7.34534 numMergedOcc 0
13 mol 78 unq 1 iso 0 dist 6.54194 7.65495 4.50796 9.39265 3.63624 5.54567 numMergedOcc 0
14 mol 91 unq 0 iso 0 dist 8.91354 9.00799 9.01897 8.91998 10.8497 4.52107 numMergedOcc 0
15 mol 91 unq 1 iso 0 dist 8.91354 6.29207 9.40413 8.91998 10.8497 13.7851 numMergedOcc 0
16 mol 127 unq 0 iso 0 dist 5.83719 7.34368 4.49551 9.64136 11.1718 13.6447 numMergedOcc 0
17 mol 158 unq 0 iso 0 dist 9.38856 9.07685 7.67833 9.27714 3.91702 10.9272 numMergedOcc 0
18 mol 165 unq 0 iso 0 dist 6.85551 4.46402 8.22717 9.98689 6.21834 13.1897 numMergedOcc 0
19 mol 165 unq 1 iso 0 dist 6.85551 4.46402 8.22717 5.93144 11.5982 4.12949 numMergedOcc 0
20 mol 174 unq 0 iso 0 dist 7.27146 4.97597 9.24028 8.46317 5.30081 10.6576 numMergedOcc 0
21 mol 174 unq 1 iso 0 dist 6.25798 4.97597 8.00637 8.46317 5.41946 10.6576 numMergedOcc 0
22 mol 186 unq 0 iso 0 dist 9.2254 5.84716 14.6234 8.99777 14.1651 9.59768 numMergedOcc 0
23 mol 198 unq 0 iso 0 dist 8.51153 9.44266 6.00243 7.94413 7.14873 4.6846 numMergedOcc 0
24 mol 214 unq 0 iso 0 dist 4.36421 9.08316 9.70491 9.53899 13.6384 10.8755 numMergedOcc 0
25 mol 230 unq 0 iso 0 dist 9.24729 7.5725 6.72933 8.01593 3.86973 3.28958 numMergedOcc 0
26 mol 266 unq 0 iso 0 dist 9.0836 9.27812 4.07542 6.48382 7.63149 10.0357 numMergedOcc 0
27 mol 266 unq 1 iso 0 dist 9.62494 9.27812 8.72214 6.48382 4.39553 10.0357 numMergedOcc 0
28 mol 284 unq 0 iso 0 dist 7.74965 8.45942 9.36278 8.2236 11.8933 6.26735 numMergedOcc 0
29 mol 286 unq 0 iso 0 dist 6.83763 9.09717 8.40229 8.08382 5.76615 3.54121 numMergedOcc 0
