0 mol 9 unq 0 iso 0 dist 9.93613 11.7623 9.78006 9.03359 8.04924 5.60154 6.26276 7.28672 9.62394 9.57198 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 6.73259 8.18809 8.6385 10.1809 7.61055 4.74747 9.27369 5.30297 7.36856 7.3022 numMergedOcc 0
2 mol 26 unq 1 iso 0 dist 8.60352 7.06347 8.6385 4.53839 7.61055 4.74747 10.6535 5.30297 7.36856 7.3022 numMergedOcc 0
3 mol 44 unq 0 iso 0 dist 7.03812 11.0744 7.52117 9.60832 9.17518 5.87283 10.95 5.1728 9.6782 13.4333 numMergedOcc 0
4 mol 44 unq 1 iso 0 dist 7.03812 11.0744 7.52117 5.27237 8.21833 10.6223 10.95 5.1728 9.6782 13.2979 numMergedOcc 0
5 mol 148 unq 0 iso 0 dist 5.06687 9.27313 9.74542 11.6995 8.12589 10.2478 11.0479 7.23332 9.91993 8.73468 numMergedOcc 0
6 mol 148 unq 1 iso 0 dist 5.06687 9.27313 9.74542 11.6995 8.12589 10.2478 9.80819 7.89336 6.22055 9.73927 numMergedOcc 0
7 mol 150 unq 0 iso 0 dist 5.09809 9.25213 9.6606 11.8035 8.11592 10.2318 11.1963 7.35366 9.96691 8.73558 numMergedOcc 0
8 mol 150 unq 1 iso 0 dist 5.09809 9.25213 9.6606 11.8035 8.11592 10.2318 9.81665 7.86976 6.14675 9.66129 numMergedOcc 0
9 mol 150 unq 2 iso 0 dist 5.09809 9.25213 9.6606 11.8035 8.11592 10.2318 13.8927 11.8012 9.24244 12.6576 numMergedOcc 0
10 mol 159 unq 0 iso 0 dist 9.90625 10.6428 7.25742 8.34466 7.13269 4.57561 18.0894 10.3427 9.17787 10.4588 numMergedOcc 0
11 mol 159 unq 1 iso 0 dist 9.90625 10.6428 7.25742 8.34466 7.13269 4.57561 12.8147 7.97232 8.4858 5.9032 numMergedOcc 0
12 mol 175 unq 0 iso 0 dist 9.12296 4.27736 7.35824 10.3187 7.01126 11.1651 13.6335 10.3786 9.39352 16.3661 numMergedOcc 0
13 mol 194 unq 0 iso 0 dist 7.47107 10.2633 6.26839 11.5684 9.77862 15.9311 13.3459 5.92931 8.65535 11.6497 numMergedOcc 0
14 mol 194 unq 1 iso 0 dist 7.47107 7.72655 8.83356 11.5684 9.77862 5.38925 10.0521 12.361 8.29382 13.132 numMergedOcc 0
15 mol 194 unq 2 iso 0 dist 7.47107 7.72655 8.83356 11.5684 9.77862 5.38925 9.76361 7.50057 6.72379 9.3402 numMergedOcc 0
16 mol 240 unq 0 iso 0 dist 8.44671 15.9853 9.47583 7.4874 8.33853 10.7371 22.5716 15.5587 6.68687 17.0428 numMergedOcc 0
17 mol 240 unq 1 iso 0 dist 8.44671 15.9853 9.47583 3.97303 5.66537 13.9225 22.5716 15.5587 6.68687 20.2034 numMergedOcc 0
18 mol 279 unq 0 iso 0 dist 5.63154 8.33297 6.43341 7.73611 8.23056 7.18967 11.3989 5.89415 9.09855 12.8413 numMergedOcc 0
