0 mol 5 unq 0 iso 0 dist 8.25372 10.7254 7.44029 4.55134 4.98321 6.38154 numMergedOcc 0
1 mol 10 unq 0 iso 0 dist 7.36963 6.41686 6.50444 11.6833 7.14537 6.23648 numMergedOcc 0
2 mol 10 unq 1 iso 0 dist 7.36963 6.41686 6.50444 8.06731 9.39486 4.87706 numMergedOcc 0
3 mol 24 unq 0 iso 0 dist 9.49404 10.6901 8.94703 8.74944 8.69288 6.58064 numMergedOcc 0
4 mol 24 unq 1 iso 0 dist 9.49404 10.6901 8.94703 4.80814 7.77964 6.40447 numMergedOcc 0
5 mol 34 unq 0 iso 0 dist 8.87762 8.62176 9.81143 12.2504 7.01952 12.188 numMergedOcc 0
6 mol 34 unq 1 iso 0 dist 8.21762 8.62176 9.78839 12.2504 4.58552 12.188 numMergedOcc 0
7 mol 53 unq 0 iso 0 dist 9.06787 12.2544 5.40748 9.58409 5.40489 6.65221 numMergedOcc 0
8 mol 56 unq 0 iso 0 dist 6.86162 7.94311 7.93171 4.55988 8.77529 7.2452 numMergedOcc 0
9 mol 59 unq 0 iso 0 dist 5.14123 5.90023 9.01601 6.13703 8.66724 11.4478 numMergedOcc 0
10 mol 76 unq 0 iso 0 dist 5.65006 5.94401 6.63973 10.0759 9.08825 12.8806 numMergedOcc 0
11 mol 79 unq 0 iso 0 dist 7.56 8.97165 8.59739 6.06978 8.51259 3.45432 numMergedOcc 0
12 mol 146 unq 0 iso 0 dist 8.82192 3.96561 6.93154 13.2008 7.78784 10.5314 numMergedOcc 0
13 mol 186 unq 0 iso 0 dist 7.49839 13.7072 9.18289 8.58664 5.67168 5.33968 numMergedOcc 0
14 mol 186 unq 1 iso 0 dist 7.49839 13.7072 9.18289 6.419 7.74579 10.1509 numMergedOcc 0
15 mol 186 unq 2 iso 0 dist 7.49839 13.7072 9.18289 6.27088 5.86483 10.9974 numMergedOcc 0
16 mol 197 unq 0 iso 0 dist 5.65314 4.92187 6.90791 4.26432 6.69042 5.37149 numMergedOcc 0
17 mol 206 unq 0 iso 0 dist 8.91548 9.64485 8.79378 4.10207 9.95026 9.39446 numMergedOcc 0
18 mol 206 unq 1 iso 0 dist 8.91548 9.64485 8.79378 6.97629 9.09594 6.98142 numMergedOcc 0
19 mol 225 unq 0 iso 0 dist 4.58113 5.21233 7.25438 7.03597 6.46405 6.04066 numMergedOcc 0
20 mol 225 unq 1 iso 0 dist 9.48525 13.2026 9.49163 12.5148 9.3502 12.7552 numMergedOcc 0
21 mol 225 unq 2 iso 0 dist 9.48525 13.2026 9.49163 8.62768 9.34821 5.69755 numMergedOcc 0
22 mol 225 unq 3 iso 0 dist 9.48525 13.2026 9.49163 4.57447 6.46405 12.7092 numMergedOcc 0
23 mol 225 unq 4 iso 0 dist 9.48525 10.8267 9.99149 12.5148 9.3502 14.0407 numMergedOcc 0
24 mol 225 unq 5 iso 0 dist 9.48525 10.8267 9.99149 8.62768 9.34821 3.90755 numMergedOcc 0
25 mol 225 unq 6 iso 0 dist 9.48525 10.8267 9.99149 4.57447 6.46405 11.662 numMergedOcc 0
26 mol 233 unq 0 iso 0 dist 7.79426 6.03685 5.76164 4.12865 9.01338 4.98419 numMergedOcc 0
27 mol 279 unq 0 iso 0 dist 6.66483 3.82462 7.37488 5.58851 5.02349 6.32559 numMergedOcc 0
28 mol 279 unq 1 iso 0 dist 6.66483 3.82462 7.37488 8.15975 9.19322 4.53305 numMergedOcc 0
29 mol 279 unq 2 iso 0 dist 6.66483 12.8107 8.7503 5.58851 5.02349 7.93887 numMergedOcc 0
30 mol 279 unq 3 iso 0 dist 6.66483 12.8107 8.7503 8.15975 9.19322 9.84272 numMergedOcc 0
31 mol 279 unq 4 iso 0 dist 5.52111 6.05145 7.37488 4.84196 5.02349 6.32559 numMergedOcc 0
32 mol 279 unq 5 iso 0 dist 5.52111 6.05145 7.37488 4.98931 9.19322 4.53305 numMergedOcc 0
33 mol 279 unq 6 iso 0 dist 5.52111 5.66521 8.7503 4.84196 5.02349 7.93887 numMergedOcc 0
34 mol 279 unq 7 iso 0 dist 5.52111 5.66521 8.7503 4.98931 9.19322 9.84272 numMergedOcc 0
