0 mol 24 unq 0 iso 0 dist 8.70141 13.2653 4.93188 5.80023 9.24958 12.3067 13.5984 9.75636 8.70827 9.12854 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 8.70141 13.2653 4.93188 5.80023 9.24958 12.3067 18.4559 10.0715 6.73939 18.673 numMergedOcc 0
2 mol 24 unq 2 iso 0 dist 8.70141 5.80023 9.24958 13.2653 4.93188 12.3067 13.5984 9.75636 9.12854 8.70827 numMergedOcc 0
3 mol 25 unq 0 iso 0 dist 5.97432 6.17631 5.81959 5.59268 6.90155 10.6808 7.05148 6.61233 8.6653 7.92503 numMergedOcc 0
4 mol 25 unq 1 iso 0 dist 5.97432 5.59268 6.90155 6.17631 5.81959 10.6808 11.6272 11.0508 6.16347 16.0183 numMergedOcc 0
5 mol 25 unq 2 iso 0 dist 5.97432 5.59268 6.90155 6.17631 5.81959 10.6808 7.05148 6.61233 7.92503 8.6653 numMergedOcc 0
6 mol 26 unq 0 iso 0 dist 6.73259 8.18809 8.6385 4.09495 5.69955 9.78225 9.27369 5.30297 7.36856 10.177 numMergedOcc 0
7 mol 26 unq 1 iso 0 dist 8.60352 7.06347 8.6385 8.26353 5.69955 9.78225 10.6535 5.30297 7.36856 10.177 numMergedOcc 0
8 mol 148 unq 0 iso 0 dist 5.06687 9.27313 9.74542 5.59872 9.02318 6.83844 11.0479 7.23332 9.91993 13.4961 numMergedOcc 0
9 mol 148 unq 1 iso 0 dist 5.06687 9.27313 9.74542 5.59872 9.02318 6.83844 9.80819 7.89336 6.22055 10.8708 numMergedOcc 0
10 mol 148 unq 2 iso 0 dist 5.06687 9.27313 9.74542 8.61198 7.97543 8.72919 11.0479 7.23332 9.91993 12.1227 numMergedOcc 0
11 mol 148 unq 3 iso 0 dist 5.06687 9.27313 9.74542 8.61198 7.97543 8.72919 9.80819 7.89336 6.22055 11.2961 numMergedOcc 0
12 mol 150 unq 0 iso 0 dist 5.09809 9.25213 9.6606 8.68422 7.85526 8.77324 11.1963 7.35366 9.96691 12.1516 numMergedOcc 0
13 mol 150 unq 1 iso 0 dist 5.09809 9.25213 9.6606 8.68422 7.85526 8.77324 9.81665 7.86976 6.14675 11.2313 numMergedOcc 0
14 mol 150 unq 2 iso 0 dist 5.09809 9.25213 9.6606 8.68422 7.85526 8.77324 13.8927 11.8012 9.24244 15.2191 numMergedOcc 0
15 mol 150 unq 3 iso 0 dist 5.09809 9.25213 9.6606 5.56996 8.94552 6.98865 11.1963 7.35366 9.96691 13.6809 numMergedOcc 0
16 mol 150 unq 4 iso 0 dist 5.09809 9.25213 9.6606 5.56996 8.94552 6.98865 9.81665 7.86976 6.14675 10.9703 numMergedOcc 0
17 mol 150 unq 5 iso 0 dist 5.09809 9.25213 9.6606 5.56996 8.94552 6.98865 13.8927 11.8012 9.24244 14.9682 numMergedOcc 0
18 mol 194 unq 0 iso 0 dist 7.47107 10.2633 6.26839 9.36943 8.12346 8.0179 13.3459 5.92931 8.65535 12.0009 numMergedOcc 0
19 mol 194 unq 1 iso 0 dist 7.47107 10.2633 6.26839 7.72655 8.83356 14.6506 13.3459 5.92931 8.65535 12.645 numMergedOcc 0
20 mol 194 unq 2 iso 0 dist 7.47107 10.2633 6.26839 4.57265 8.2654 8.48054 13.3459 5.92931 8.65535 13.9101 numMergedOcc 0
21 mol 194 unq 3 iso 0 dist 7.47107 7.72655 8.83356 10.2633 6.26839 14.6506 10.0521 12.361 8.29382 16.3687 numMergedOcc 0
22 mol 194 unq 4 iso 0 dist 7.47107 7.72655 8.83356 10.2633 6.26839 14.6506 9.76361 7.50057 6.72379 12.4952 numMergedOcc 0
23 mol 194 unq 5 iso 0 dist 7.47107 7.72655 8.83356 9.36943 8.12346 13.5632 10.0521 12.361 8.29382 18.4977 numMergedOcc 0
24 mol 194 unq 6 iso 0 dist 7.47107 7.72655 8.83356 9.36943 8.12346 13.5632 9.76361 7.50057 6.72379 15.1649 numMergedOcc 0
25 mol 194 unq 7 iso 0 dist 7.47107 7.72655 8.83356 4.57265 8.2654 11.6097 10.0521 12.361 8.29382 14.3769 numMergedOcc 0
26 mol 194 unq 8 iso 0 dist 7.47107 7.72655 8.83356 4.57265 8.2654 11.6097 9.76361 7.50057 6.72379 13.2138 numMergedOcc 0
27 mol 235 unq 0 iso 0 dist 9.77502 13.1002 6.39158 6.64857 7.75722 12.1984 9.52022 7.85398 6.36341 12.0305 numMergedOcc 0
28 mol 240 unq 0 iso 0 dist 8.44671 15.9853 9.47583 13.1893 8.44909 4.28414 22.5716 15.5587 6.68687 10.5594 numMergedOcc 0
29 mol 258 unq 0 iso 0 dist 8.78354 11.5659 6.70815 11.716 7.99477 7.26417 16.2957 8.10604 7.21311 11.2102 numMergedOcc 0
30 mol 279 unq 0 iso 0 dist 5.63154 8.33297 6.43341 5.15837 8.29305 6.67478 11.3989 5.89415 9.09855 13.6219 numMergedOcc 0
