0 mol 24 unq 0 iso 0 dist 6.01284 5.02954 3.33439 7.19293 11.8224 9.58192 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 9.45579 5.02954 4.56606 7.19293 13.023 9.58192 numMergedOcc 0
2 mol 39 unq 0 iso 0 dist 7.99016 8.55553 5.84083 6.3982 8.54587 9.17793 numMergedOcc 0
3 mol 39 unq 1 iso 0 dist 6.41793 8.55553 5.16873 6.3982 5.27182 9.17793 numMergedOcc 0
4 mol 39 unq 2 iso 0 dist 6.50101 8.55553 3.08793 6.3982 9.12545 9.17793 numMergedOcc 0
5 mol 48 unq 0 iso 0 dist 9.85865 7.05619 16.1553 5.49377 11.2974 7.7927 numMergedOcc 0
6 mol 48 unq 1 iso 0 dist 9.85865 7.05619 16.1553 6.47829 12.4519 6.17378 numMergedOcc 0
7 mol 48 unq 2 iso 0 dist 8.74946 7.05619 15.5559 5.49377 10.1132 7.7927 numMergedOcc 0
8 mol 48 unq 3 iso 0 dist 8.74946 7.05619 15.5559 6.47829 12.1989 6.17378 numMergedOcc 0
9 mol 93 unq 0 iso 0 dist 6.18348 6.25522 5.31693 13.8087 11.9048 8.28591 numMergedOcc 0
10 mol 93 unq 1 iso 0 dist 6.18348 6.25522 5.31693 9.96831 10.293 5.35008 numMergedOcc 0
11 mol 93 unq 2 iso 0 dist 6.18348 6.25522 5.31693 5.33894 7.23305 8.30921 numMergedOcc 0
12 mol 93 unq 3 iso 0 dist 6.18348 7.87145 3.09636 13.8087 11.9048 9.40687 numMergedOcc 0
13 mol 93 unq 4 iso 0 dist 6.18348 7.87145 3.09636 9.96831 10.293 8.84576 numMergedOcc 0
14 mol 93 unq 5 iso 0 dist 6.18348 7.87145 3.09636 5.33894 7.23305 7.39732 numMergedOcc 0
15 mol 93 unq 6 iso 0 dist 6.18348 9.30914 3.7348 5.33894 7.23305 9.67744 numMergedOcc 0
16 mol 141 unq 0 iso 0 dist 6.99125 5.4206 3.37046 5.56306 10.1173 7.56563 numMergedOcc 0
17 mol 152 unq 0 iso 0 dist 6.09987 5.42715 6.15601 10.6183 10.4667 8.60651 numMergedOcc 0
18 mol 152 unq 1 iso 0 dist 6.92726 7.34557 6.15601 4.71678 10.4667 8.60651 numMergedOcc 0
19 mol 158 unq 0 iso 0 dist 6.11331 8.06621 11.6769 12.4672 15.987 6.77583 numMergedOcc 0
20 mol 186 unq 0 iso 0 dist 8.31881 9.12783 3.11607 12.0756 9.98715 7.36794 numMergedOcc 0
21 mol 186 unq 1 iso 0 dist 8.31881 9.12783 3.11607 9.57029 8.39342 5.81881 numMergedOcc 0
22 mol 213 unq 0 iso 0 dist 9.62911 7.56327 8.61517 4.8113 14.2228 9.97325 numMergedOcc 0
23 mol 214 unq 0 iso 0 dist 8.21997 6.20118 3.14057 6.28124 8.25329 8.49349 numMergedOcc 0
24 mol 218 unq 0 iso 0 dist 8.04838 6.62738 9.10705 3.85314 11.2455 6.17843 numMergedOcc 0
25 mol 218 unq 1 iso 0 dist 8.04838 7.13254 8.25033 3.85314 11.2455 8.52772 numMergedOcc 0
26 mol 292 unq 0 iso 0 dist 9.2558 8.42359 3.08474 11.4284 9.23612 9.21469 numMergedOcc 0
27 mol 292 unq 1 iso 0 dist 9.84946 8.42359 6.12546 11.4284 11.928 9.21469 numMergedOcc 0
