0 mol 20 unq 0 iso 0 dist 5.9809 4.49303 7.99756 8.19827 4.7579 7.47395 numMergedOcc 0
1 mol 20 unq 1 iso 0 dist 5.83917 4.49303 4.36087 8.19827 3.21365 7.47395 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 7.882 3.76025 6.52283 7.4403 3.41186 4.75881 numMergedOcc 0
3 mol 34 unq 1 iso 0 dist 6.016 8.50202 6.52283 8.61815 3.41186 4.75881 numMergedOcc 0
4 mol 34 unq 2 iso 0 dist 8.38156 12.0023 6.52283 10.5494 3.41186 4.75881 numMergedOcc 0
5 mol 68 unq 0 iso 0 dist 7.95451 6.85428 8.71074 12.0508 7.18877 7.7485 numMergedOcc 0
6 mol 113 unq 0 iso 0 dist 5.29949 5.46299 9.60127 9.69937 13.8379 7.16619 numMergedOcc 0
7 mol 113 unq 1 iso 0 dist 5.29949 5.46299 9.60127 5.45882 8.39067 5.88896 numMergedOcc 0
8 mol 143 unq 0 iso 0 dist 7.46803 4.19541 6.60366 8.08798 5.94217 4.3855 numMergedOcc 0
9 mol 168 unq 0 iso 0 dist 7.06851 7.8982 8.21227 12.5943 9.99868 5.86767 numMergedOcc 0
10 mol 168 unq 1 iso 0 dist 7.06851 7.8982 8.21227 10.3398 6.91388 5.28353 numMergedOcc 0
11 mol 194 unq 0 iso 0 dist 6.11135 8.27947 6.68939 9.58477 5.43825 9.55626 numMergedOcc 0
12 mol 194 unq 1 iso 0 dist 6.54481 7.01398 6.68939 11.9016 5.43825 9.55626 numMergedOcc 0
13 mol 194 unq 2 iso 0 dist 8.03403 4.03124 6.68939 12.3444 5.43825 9.55626 numMergedOcc 0
14 mol 204 unq 0 iso 0 dist 8.66162 3.99343 7.33774 7.76863 4.7839 8.32259 numMergedOcc 0
15 mol 204 unq 1 iso 0 dist 8.66162 3.99343 7.33774 10.2353 4.05102 9.93489 numMergedOcc 0
16 mol 204 unq 2 iso 0 dist 8.66162 11.4601 6.39122 7.76863 4.7839 8.54737 numMergedOcc 0
17 mol 204 unq 3 iso 0 dist 8.66162 11.4601 6.39122 10.2353 4.05102 7.64057 numMergedOcc 0
18 mol 204 unq 4 iso 0 dist 5.3819 6.68247 8.23717 4.51124 5.80328 8.32259 numMergedOcc 0
19 mol 204 unq 5 iso 0 dist 5.3819 6.68247 8.23717 8.41517 3.68217 8.54737 numMergedOcc 0
20 mol 204 unq 6 iso 0 dist 5.3819 7.51762 7.98864 4.51124 5.80328 9.93489 numMergedOcc 0
21 mol 204 unq 7 iso 0 dist 5.3819 7.51762 7.98864 8.41517 3.68217 7.64057 numMergedOcc 0
22 mol 214 unq 0 iso 0 dist 9.58372 6.05252 7.70062 14.0046 7.87816 8.66082 numMergedOcc 0
23 mol 214 unq 1 iso 0 dist 9.58372 6.05252 7.70062 7.72298 3.64285 7.96338 numMergedOcc 0
24 mol 214 unq 2 iso 0 dist 9.58372 4.00138 7.66702 7.72298 3.64285 7.42759 numMergedOcc 0
25 mol 254 unq 0 iso 0 dist 9.66641 6.19835 5.6417 7.23916 8.8967 7.85841 numMergedOcc 0
26 mol 254 unq 1 iso 0 dist 9.66641 6.19835 5.6417 6.12653 10.929 9.20109 numMergedOcc 0
27 mol 254 unq 2 iso 0 dist 9.26575 6.19835 7.42831 7.23916 9.42679 7.85841 numMergedOcc 0
28 mol 254 unq 3 iso 0 dist 9.26575 6.19835 7.42831 6.12653 10.706 9.20109 numMergedOcc 0
29 mol 260 unq 0 iso 0 dist 8.5613 6.03233 9.73217 10.0128 15.6308 8.62655 numMergedOcc 0
30 mol 260 unq 1 iso 0 dist 5.7791 7.66564 9.73217 14.7837 15.6308 8.62655 numMergedOcc 0
31 mol 287 unq 0 iso 0 dist 8.9466 4.04301 6.22311 9.92253 5.96434 6.24487 numMergedOcc 0
32 mol 287 unq 1 iso 0 dist 8.59762 8.99193 4.93516 5.50067 3.66473 4.68668 numMergedOcc 0
33 mol 288 unq 0 iso 0 dist 8.9466 4.04301 6.22311 9.92253 5.96434 6.24487 numMergedOcc 0
34 mol 288 unq 1 iso 0 dist 8.59762 8.99193 4.93516 5.50067 3.66473 4.68668 numMergedOcc 0
35 mol 289 unq 0 iso 0 dist 8.9466 4.04301 6.22311 9.92253 5.96434 6.24487 numMergedOcc 0
36 mol 289 unq 1 iso 0 dist 8.59762 8.99193 4.93516 5.50067 3.66473 4.68668 numMergedOcc 0
