0 mol 0 unq 0 iso 0 dist 7.96742 5.55156 11.962 10.8652 8.66612 15.361 7.16694 14.4281 6.94181 17.4113 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 7.96742 5.55156 11.962 10.8257 8.84413 16.3722 7.16694 14.4281 6.94181 15.5192 numMergedOcc 0
2 mol 0 unq 2 iso 0 dist 6.19218 9.5614 6.83587 6.82018 7.19397 5.55156 9.40697 10.9707 6.94181 7.16694 numMergedOcc 0
3 mol 0 unq 3 iso 0 dist 7.19397 5.55156 6.83587 6.82018 6.19218 9.5614 7.16694 10.9707 6.94181 9.40697 numMergedOcc 0
4 mol 7 unq 0 iso 0 dist 9.32945 6.22805 4.57188 17.0748 9.67498 13.9815 5.85668 10.2084 7.15434 17.1023 numMergedOcc 0
5 mol 68 unq 0 iso 0 dist 7.19203 7.14865 9.51008 9.29911 8.8095 13.5752 10.0636 15.9868 9.20523 18.8251 numMergedOcc 0
6 mol 73 unq 0 iso 0 dist 8.60363 4.24428 10.4402 16.6115 9.27331 16.702 6.13631 6.99156 6.10011 11.9439 numMergedOcc 0
7 mol 73 unq 1 iso 0 dist 8.60363 6.30194 8.0624 16.6115 9.27331 14.6804 6.13631 6.99156 8.124 11.9439 numMergedOcc 0
8 mol 100 unq 0 iso 0 dist 6.60356 9.57498 14.3495 9.81157 7.11187 19.211 9.16553 15.2864 8.96916 17.7098 numMergedOcc 0
9 mol 230 unq 0 iso 0 dist 6.88683 8.33847 6.87235 5.96129 7.43793 9.12305 11.8106 12.0105 5.62804 11.2815 numMergedOcc 0
10 mol 230 unq 1 iso 0 dist 7.43793 9.12305 6.87235 5.96129 6.88683 8.33847 11.2815 12.0105 5.62804 11.8106 numMergedOcc 0
11 mol 230 unq 2 iso 0 dist 7.43793 9.30906 5.4427 5.96129 6.88683 10.6587 11.2815 12.0105 9.3619 11.8106 numMergedOcc 0
12 mol 232 unq 0 iso 0 dist 5.92175 7.47238 4.90814 4.22519 7.76477 11.026 16.9546 14.5058 9.95045 20.8485 numMergedOcc 0
13 mol 232 unq 1 iso 0 dist 5.92175 7.47238 4.90814 9.1904 6.82688 10.8093 16.9546 14.5058 9.95045 19.9315 numMergedOcc 0
14 mol 265 unq 0 iso 0 dist 9.56472 7.54805 15.4199 12.462 9.50814 13.929 5.46523 13.9472 5.3051 13.528 numMergedOcc 0
15 mol 274 unq 0 iso 0 dist 9.07452 6.21831 6.57235 10.1431 6.44266 8.3291 6.33183 12.136 8.78883 9.34663 numMergedOcc 0
16 mol 274 unq 1 iso 0 dist 7.21004 6.21831 4.97216 10.1431 8.75703 8.3291 6.33183 5.68643 8.78883 9.34663 numMergedOcc 0
17 mol 274 unq 2 iso 0 dist 6.44266 8.3291 6.57235 10.1431 9.07452 6.21831 9.34663 12.136 8.78883 6.33183 numMergedOcc 0
18 mol 274 unq 3 iso 0 dist 8.75703 8.3291 4.97216 10.1431 7.21004 6.21831 9.34663 5.68643 8.78883 6.33183 numMergedOcc 0
19 mol 279 unq 0 iso 0 dist 5.78017 6.47376 5.34376 6.22487 6.12742 9.6147 4.77763 8.36655 8.68797 5.44699 numMergedOcc 0
20 mol 279 unq 1 iso 0 dist 6.12742 9.6147 5.34376 6.22487 5.78017 6.47376 5.44699 8.36655 8.68797 4.77763 numMergedOcc 0
