0 mol 4 unq 0 iso 0 dist 6.04705 6.3317 7.12033 8.97732 8.24634 13.5812 numMergedOcc 0
1 mol 4 unq 1 iso 0 dist 6.04705 6.3317 7.12033 12.7591 9.16617 15.6201 numMergedOcc 0
2 mol 4 unq 2 iso 0 dist 6.04705 6.3317 7.12033 9.49251 8.87255 12.9404 numMergedOcc 0
3 mol 19 unq 0 iso 0 dist 8.18518 5.96899 9.32418 10.5195 6.41575 14.3484 numMergedOcc 0
4 mol 30 unq 0 iso 0 dist 8.37503 7.88072 9.52037 7.07473 8.1284 12.4297 numMergedOcc 0
5 mol 41 unq 0 iso 0 dist 4.68793 7.7727 9.50094 8.68242 8.51663 12.0668 numMergedOcc 0
6 mol 54 unq 0 iso 0 dist 8.62769 6.81735 6.91496 11.1809 7.07339 13.1774 numMergedOcc 0
7 mol 54 unq 1 iso 0 dist 8.62769 6.81735 6.91496 7.13002 7.23317 11.0484 numMergedOcc 0
8 mol 95 unq 0 iso 0 dist 8.26838 9.02905 4.73066 9.61054 9.49454 13.7457 numMergedOcc 0
9 mol 124 unq 0 iso 0 dist 7.23052 8.50362 9.79481 5.34732 6.96281 12.2019 numMergedOcc 0
10 mol 143 unq 0 iso 0 dist 7.5984 5.33772 6.75249 11.4055 7.78652 13.6073 numMergedOcc 0
11 mol 143 unq 1 iso 0 dist 7.5984 5.33772 6.75249 9.54731 8.91301 12.9862 numMergedOcc 0
12 mol 143 unq 2 iso 0 dist 8.11202 9.12935 7.02542 5.2832 6.6554 10.6831 numMergedOcc 0
13 mol 163 unq 0 iso 0 dist 6.56115 9.69093 4.2768 10.8796 9.07943 12.6932 numMergedOcc 0
14 mol 175 unq 0 iso 0 dist 9.45659 8.06007 13.5565 14.0022 9.77896 20.3844 numMergedOcc 0
15 mol 204 unq 0 iso 0 dist 7.7292 6.46946 6.49075 16.5925 9.68728 15.6821 numMergedOcc 0
16 mol 204 unq 1 iso 0 dist 6.27396 6.46946 8.62057 7.76353 9.1458 14.0881 numMergedOcc 0
17 mol 206 unq 0 iso 0 dist 7.10166 9.58346 3.56132 14.2366 7.75885 7.9416 numMergedOcc 0
18 mol 206 unq 1 iso 0 dist 9.66896 9.60549 3.56132 5.91675 7.75885 7.9416 numMergedOcc 0
19 mol 219 unq 0 iso 0 dist 8.09769 8.58891 10.0702 6.66401 7.59632 10.1516 numMergedOcc 0
20 mol 231 unq 0 iso 0 dist 9.98232 8.37596 8.58535 11.1156 7.79066 14.3516 numMergedOcc 0
21 mol 238 unq 0 iso 0 dist 8.89538 8.62485 5.7648 16.6173 8.67864 11.9026 numMergedOcc 0
22 mol 238 unq 1 iso 0 dist 8.89538 9.37688 9.56124 16.6173 8.67864 15.5184 numMergedOcc 0
23 mol 273 unq 0 iso 0 dist 6.54753 8.13393 5.07045 7.10817 8.83865 11.6839 numMergedOcc 0
24 mol 274 unq 0 iso 0 dist 9.81087 8.67957 10.7853 13.6675 7.46394 17.7727 numMergedOcc 0
25 mol 280 unq 0 iso 0 dist 8.40961 7.00616 4.51188 5.87081 9.76787 9.47429 numMergedOcc 0
26 mol 280 unq 1 iso 0 dist 9.42213 9.19653 4.51188 11.8683 9.76787 9.47429 numMergedOcc 0
27 mol 284 unq 0 iso 0 dist 8.08993 8.2236 14.4667 7.98227 7.8343 15.7268 numMergedOcc 0
28 mol 284 unq 1 iso 0 dist 7.34344 8.2236 12.4957 6.50962 6.78191 7.74874 numMergedOcc 0
