0 mol 5 unq 0 iso 0 dist 9.12986 9.45559 6.64785 9.59917 10.1441 7.74636 numMergedOcc 0
1 mol 5 unq 1 iso 0 dist 9.12986 7.4332 6.34673 8.94762 13.752 8.34817 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 9.21068 8.9776 3.30351 6.75063 6.55728 8.31631 numMergedOcc 0
3 mol 24 unq 1 iso 0 dist 7.84552 5.65754 7.19357 5.61248 5.13078 7.7447 numMergedOcc 0
4 mol 30 unq 0 iso 0 dist 7.75449 7.88072 3.30907 4.5844 9.26667 8.67216 numMergedOcc 0
5 mol 48 unq 0 iso 0 dist 8.69374 7.49794 11.3226 11.3706 17.4504 7.70645 numMergedOcc 0
6 mol 63 unq 0 iso 0 dist 9.25631 6.89855 5.98039 5.74753 6.8848 8.78414 numMergedOcc 0
7 mol 63 unq 1 iso 0 dist 7.87739 7.85738 5.98039 5.82517 6.8848 8.78414 numMergedOcc 0
8 mol 68 unq 0 iso 0 dist 9.00217 5.26566 5.29172 9.4465 6.33905 8.71074 numMergedOcc 0
9 mol 69 unq 0 iso 0 dist 6.07747 7.17133 6.26218 15.9536 14.3074 9.08745 numMergedOcc 0
10 mol 85 unq 0 iso 0 dist 8.96872 9.43839 11.4354 11.053 10.9955 4.29937 numMergedOcc 0
11 mol 85 unq 1 iso 0 dist 8.96872 9.43839 11.4354 7.97629 10.8022 3.65628 numMergedOcc 0
12 mol 85 unq 2 iso 0 dist 8.96872 9.43839 11.4354 5.46713 13.1621 9.77774 numMergedOcc 0
13 mol 91 unq 0 iso 0 dist 9.00799 8.91998 4.52107 5.09341 5.97918 7.71625 numMergedOcc 0
14 mol 91 unq 1 iso 0 dist 6.29207 8.91998 13.7851 5.09341 11.042 7.71625 numMergedOcc 0
15 mol 93 unq 0 iso 0 dist 8.70907 8.55758 9.96742 5.84807 12.7611 6.67678 numMergedOcc 0
16 mol 93 unq 1 iso 0 dist 8.70907 7.44027 7.75947 5.84807 12.7611 7.24956 numMergedOcc 0
17 mol 107 unq 0 iso 0 dist 6.99676 7.2168 3.35244 9.89064 6.71858 5.31375 numMergedOcc 0
18 mol 107 unq 1 iso 0 dist 6.99676 7.2168 3.35244 13.076 9.37159 6.49371 numMergedOcc 0
19 mol 127 unq 0 iso 0 dist 7.34368 9.64136 13.6447 9.74982 15.8154 8.09691 numMergedOcc 0
20 mol 158 unq 0 iso 0 dist 9.07685 9.27714 10.9272 11.3047 14.3449 6.77583 numMergedOcc 0
21 mol 214 unq 0 iso 0 dist 9.08316 9.53899 10.8755 10.0389 16.2661 7.66702 numMergedOcc 0
22 mol 260 unq 0 iso 0 dist 8.99274 6.90472 5.99357 4.35925 9.46465 9.73217 numMergedOcc 0
23 mol 260 unq 1 iso 0 dist 8.99274 6.90472 5.99357 13.8859 11.7154 7.49606 numMergedOcc 0
24 mol 260 unq 2 iso 0 dist 8.99274 6.90472 5.99357 13.5662 11.0395 8.06377 numMergedOcc 0
25 mol 266 unq 0 iso 0 dist 9.27812 6.48382 10.0357 7.90149 11.379 8.20376 numMergedOcc 0
26 mol 287 unq 0 iso 0 dist 8.71214 8.17436 7.67746 7.94344 11.4121 4.93516 numMergedOcc 0
27 mol 288 unq 0 iso 0 dist 8.71214 8.17436 7.67746 7.94344 11.4121 4.93516 numMergedOcc 0
28 mol 289 unq 0 iso 0 dist 8.71214 8.17436 7.67746 7.94344 11.4121 4.93516 numMergedOcc 0
