0 mol 20 unq 0 iso 0 dist 9.47968 7.6974 12.4511 12.6153 8.72023 15.0643 8.3037 5.11883 10.9013 4.9399 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 8.70141 8.6586 4.21283 13.2653 4.93188 8.23075 9.42167 4.87192 7.18124 7.6222 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 8.70141 8.6586 4.21283 5.80023 9.24958 10.551 9.42167 4.87192 7.18124 11.7026 numMergedOcc 0
3 mol 120 unq 0 iso 0 dist 9.27951 9.58434 9.74634 5.89379 8.93905 10.2878 13.2271 9.23243 18.3574 12.4334 numMergedOcc 0
4 mol 120 unq 1 iso 0 dist 9.27951 9.16089 9.23272 5.89379 8.93905 6.42623 13.2271 9.23243 16.3967 12.4334 numMergedOcc 0
5 mol 148 unq 0 iso 0 dist 5.06687 6.81449 3.94083 5.59872 9.02318 11.9962 3.78181 6.49708 8.88297 5.29844 numMergedOcc 0
6 mol 148 unq 1 iso 0 dist 5.06687 6.81449 3.94083 9.27313 9.74542 13.3633 3.78181 6.49708 8.88297 6.55924 numMergedOcc 0
7 mol 148 unq 2 iso 0 dist 5.06687 6.81449 3.94083 8.61198 7.97543 11.4505 3.78181 6.49708 8.88297 9.61708 numMergedOcc 0
8 mol 150 unq 0 iso 0 dist 5.09809 6.87593 3.99423 9.25213 9.6606 13.3193 3.72958 6.45018 8.82984 6.62435 numMergedOcc 0
9 mol 150 unq 1 iso 0 dist 5.09809 6.87593 3.99423 8.68422 7.85526 11.3898 3.72958 6.45018 8.82984 9.72618 numMergedOcc 0
10 mol 150 unq 2 iso 0 dist 5.09809 6.87593 3.99423 5.56996 8.94552 11.9796 3.72958 6.45018 8.82984 5.50847 numMergedOcc 0
11 mol 162 unq 0 iso 0 dist 8.48559 9.067 5.21512 6.46702 6.20182 7.93088 10.7014 6.00293 9.67872 5.05715 numMergedOcc 0
12 mol 163 unq 0 iso 0 dist 5.80513 9.37245 12.99 4.12904 8.38738 8.16252 7.55428 7.27002 16.9215 10.1139 numMergedOcc 0
13 mol 194 unq 0 iso 0 dist 7.47107 8.76748 14.7863 10.2633 6.26839 17.6834 9.86028 7.39369 17.8268 11.1912 numMergedOcc 0
14 mol 194 unq 1 iso 0 dist 7.47107 8.76748 14.7863 9.36943 8.12346 18.0997 9.86028 7.39369 17.8268 6.11279 numMergedOcc 0
15 mol 194 unq 2 iso 0 dist 7.47107 8.76748 14.7863 7.72655 8.83356 10.6393 9.86028 7.39369 17.8268 9.99597 numMergedOcc 0
16 mol 194 unq 3 iso 0 dist 7.47107 8.76748 14.7863 4.57265 8.2654 12.5685 9.86028 7.39369 17.8268 9.50345 numMergedOcc 0
17 mol 210 unq 0 iso 0 dist 7.31388 9.49242 15.3751 3.84723 5.37446 11.1783 9.54557 9.40123 16.6242 7.09658 numMergedOcc 0
18 mol 210 unq 1 iso 0 dist 7.31388 9.25184 7.61953 3.84723 5.37446 6.85824 9.54557 9.40123 12.3489 7.09658 numMergedOcc 0
19 mol 285 unq 0 iso 0 dist 6.89391 5.28731 6.89311 4.16039 5.31728 5.03601 8.06603 5.04032 10.4548 6.40962 numMergedOcc 0
