0 mol 1 unq 0 iso 0 dist 8.10712 9.40282 14.5115 8.93702 11.6941 5.11735 numMergedOcc 0
1 mol 1 unq 1 iso 0 dist 8.10712 9.35554 5.59021 8.93702 11.6941 9.01967 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 9.3613 8.36524 12.6572 5.73257 14.5006 8.90278 numMergedOcc 0
3 mol 43 unq 0 iso 0 dist 7.19567 6.84521 10.1001 7.84444 4.40061 8.01951 numMergedOcc 0
4 mol 43 unq 1 iso 0 dist 7.19567 8.90024 14.2671 7.84444 4.40061 12.2025 numMergedOcc 0
5 mol 43 unq 2 iso 0 dist 7.19567 6.78532 10.3556 7.84444 4.40061 7.68348 numMergedOcc 0
6 mol 43 unq 3 iso 0 dist 9.34433 6.84521 12.3867 7.84444 11.3924 8.01951 numMergedOcc 0
7 mol 43 unq 4 iso 0 dist 9.34433 8.90024 12.0037 7.84444 11.3924 12.2025 numMergedOcc 0
8 mol 43 unq 5 iso 0 dist 9.34433 6.78532 6.9067 7.84444 11.3924 7.68348 numMergedOcc 0
9 mol 62 unq 0 iso 0 dist 6.09042 8.27156 10.894 4.89196 6.03786 5.49555 numMergedOcc 0
10 mol 72 unq 0 iso 0 dist 8.06901 5.48831 5.86484 7.95972 6.21876 7.17489 numMergedOcc 0
11 mol 72 unq 1 iso 0 dist 8.06901 9.39178 8.82422 7.95972 6.21876 12.6531 numMergedOcc 0
12 mol 94 unq 0 iso 0 dist 6.63924 6.31237 6.0901 6.64613 6.8527 7.39788 numMergedOcc 0
13 mol 128 unq 0 iso 0 dist 8.20904 8.3127 11.1747 9.81998 9.60731 4.64539 numMergedOcc 0
14 mol 148 unq 0 iso 0 dist 6.4413 7.95671 5.34721 8.274 5.27089 5.29104 numMergedOcc 0
15 mol 150 unq 0 iso 0 dist 6.62609 8.12659 5.38822 8.39743 5.24014 5.45499 numMergedOcc 0
16 mol 178 unq 0 iso 0 dist 9.3355 8.04723 13.6129 5.85439 8.41654 5.25267 numMergedOcc 0
17 mol 181 unq 0 iso 0 dist 9.614 8.27794 11.0057 9.34871 13.6798 6.14208 numMergedOcc 0
18 mol 181 unq 1 iso 0 dist 9.614 8.27794 11.0057 5.55727 7.55918 5.95965 numMergedOcc 0
19 mol 187 unq 0 iso 0 dist 9.55621 9.38169 4.98423 9.25105 8.43209 6.62321 numMergedOcc 0
20 mol 187 unq 1 iso 0 dist 8.8048 9.38169 10.0429 9.25105 5.72599 6.62321 numMergedOcc 0
21 mol 189 unq 0 iso 0 dist 8.01521 8.59972 6.36139 5.79707 8.33972 5.59904 numMergedOcc 0
22 mol 209 unq 0 iso 0 dist 9.20752 5.92907 9.95971 5.20111 5.80388 6.43758 numMergedOcc 0
23 mol 266 unq 0 iso 0 dist 6.20998 6.95233 5.98169 9.15288 5.18289 4.27792 numMergedOcc 0
24 mol 266 unq 1 iso 0 dist 6.20998 6.95233 5.98169 6.11795 12.2123 11.5523 numMergedOcc 0
25 mol 266 unq 2 iso 0 dist 6.20998 9.61741 13.6708 9.15288 5.18289 14.2479 numMergedOcc 0
26 mol 266 unq 3 iso 0 dist 6.20998 9.61741 13.6708 6.11795 12.2123 6.98866 numMergedOcc 0
27 mol 266 unq 4 iso 0 dist 6.20998 5.61056 10.2407 9.15288 5.18289 10.5058 numMergedOcc 0
28 mol 266 unq 5 iso 0 dist 6.20998 5.61056 10.2407 6.11795 12.2123 5.19574 numMergedOcc 0
29 mol 266 unq 6 iso 0 dist 8.78219 6.95233 13.8919 9.15288 15.1255 4.27792 numMergedOcc 0
30 mol 266 unq 7 iso 0 dist 8.78219 6.95233 13.8919 6.11795 12.0826 11.5523 numMergedOcc 0
31 mol 266 unq 8 iso 0 dist 8.78219 9.61741 16.7981 9.15288 15.1255 14.2479 numMergedOcc 0
32 mol 266 unq 9 iso 0 dist 8.78219 9.61741 16.7981 6.11795 12.0826 6.98866 numMergedOcc 0
33 mol 266 unq 10 iso 0 dist 8.78219 5.61056 14.0884 9.15288 15.1255 10.5058 numMergedOcc 0
34 mol 266 unq 11 iso 0 dist 8.78219 5.61056 14.0884 6.11795 12.0826 5.19574 numMergedOcc 0
35 mol 273 unq 0 iso 0 dist 7.29081 9.79022 11.0966 9.93542 10.5519 7.00883 numMergedOcc 0
36 mol 280 unq 0 iso 0 dist 3.97964 6.52188 6.0971 6.78323 5.97333 6.24406 numMergedOcc 0
37 mol 280 unq 1 iso 0 dist 7.72152 6.52188 6.96139 6.78323 12.0122 6.24406 numMergedOcc 0
