0 mol 13 unq 0 iso 0 dist 6.6621 9.92193 9.7299 5.87938 10.4313 7.42612 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 9.67926 8.13365 10.0637 6.09311 11.8553 7.49157 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 9.67926 8.13365 10.0637 9.56533 14.7097 7.73794 numMergedOcc 0
3 mol 38 unq 0 iso 0 dist 7.98333 9.70612 5.39129 4.46801 5.17241 7.68478 numMergedOcc 0
4 mol 38 unq 1 iso 0 dist 7.98333 6.46781 5.29179 4.46801 5.17241 6.87122 numMergedOcc 0
5 mol 111 unq 0 iso 0 dist 7.95205 7.42431 4.48869 3.83194 8.48433 9.06601 numMergedOcc 0
6 mol 111 unq 1 iso 0 dist 7.95205 7.42431 4.48869 5.56913 9.30841 5.98809 numMergedOcc 0
7 mol 127 unq 0 iso 0 dist 9.78409 8.09965 9.75166 5.12492 10.6731 5.39356 numMergedOcc 0
8 mol 127 unq 1 iso 0 dist 9.78409 8.09965 9.75166 9.6877 16.641 9.92746 numMergedOcc 0
9 mol 130 unq 0 iso 0 dist 9.79676 7.94863 11.8666 5.17954 10.569 5.92733 numMergedOcc 0
10 mol 152 unq 0 iso 0 dist 9.59193 9.37459 13.2016 10.6933 16.9953 6.79114 numMergedOcc 0
11 mol 152 unq 1 iso 0 dist 9.59193 9.37459 13.2016 5.0146 13.1726 7.59457 numMergedOcc 0
12 mol 152 unq 2 iso 0 dist 9.59193 9.0847 14.0443 5.0146 13.1726 9.00072 numMergedOcc 0
13 mol 152 unq 3 iso 0 dist 9.59193 6.00061 7.99896 5.0146 13.1726 7.55419 numMergedOcc 0
14 mol 186 unq 0 iso 0 dist 9.4588 8.16369 10.591 12.0957 15.5664 5.90765 numMergedOcc 0
15 mol 205 unq 0 iso 0 dist 7.9678 6.04106 6.4623 3.95968 5.32465 7.13783 numMergedOcc 0
16 mol 238 unq 0 iso 0 dist 6.86905 6.51823 7.22173 5.61713 9.91332 6.46771 numMergedOcc 0
17 mol 257 unq 0 iso 0 dist 8.42116 8.95261 5.86413 7.65595 11.1583 9.6834 numMergedOcc 0
18 mol 257 unq 1 iso 0 dist 8.53984 7.80336 5.86413 3.41163 11.1583 9.6834 numMergedOcc 0
19 mol 257 unq 2 iso 0 dist 9.11074 8.95261 13.8679 7.65595 16.6138 9.6834 numMergedOcc 0
20 mol 265 unq 0 iso 0 dist 5.81967 5.89409 8.31727 3.42654 5.14151 8.54108 numMergedOcc 0
21 mol 265 unq 1 iso 0 dist 9.19106 7.45719 8.31727 5.12694 5.14151 8.54108 numMergedOcc 0
22 mol 265 unq 2 iso 0 dist 5.14122 8.59825 7.8929 3.99477 6.80043 5.7944 numMergedOcc 0
23 mol 265 unq 3 iso 0 dist 5.14122 7.83102 5.56416 13.3937 11.8353 9.28128 numMergedOcc 0
