0 mol 36 unq 0 iso 0 dist 9.54644 4.10339 13.1554 6.6055 11.721 6.03866 numMergedOcc 0
1 mol 55 unq 0 iso 0 dist 8.51194 4.70371 10.3609 8.77395 11.6528 8.20593 numMergedOcc 0
2 mol 55 unq 1 iso 0 dist 8.51194 4.70371 10.3609 6.91288 13.561 6.20434 numMergedOcc 0
3 mol 55 unq 2 iso 0 dist 8.51194 4.70371 10.3609 8.60087 8.00205 9.61184 numMergedOcc 0
4 mol 55 unq 3 iso 0 dist 8.51194 8.74565 4.26654 8.77395 11.6528 13.1058 numMergedOcc 0
5 mol 55 unq 4 iso 0 dist 8.51194 8.74565 4.26654 6.91288 13.561 14.3366 numMergedOcc 0
6 mol 55 unq 5 iso 0 dist 8.51194 8.74565 4.26654 8.60087 8.00205 9.31655 numMergedOcc 0
7 mol 62 unq 0 iso 0 dist 6.69386 7.30392 5.95499 6.42645 10.4041 13.0684 numMergedOcc 0
8 mol 62 unq 1 iso 0 dist 9.09269 7.30392 16.2245 6.42645 3.70802 13.0684 numMergedOcc 0
9 mol 69 unq 0 iso 0 dist 8.61203 8.20839 4.73219 7.07055 7.7289 6.65401 numMergedOcc 0
10 mol 86 unq 0 iso 0 dist 7.1724 9.94012 10.5367 8.39775 4.35553 14.4687 numMergedOcc 0
11 mol 96 unq 0 iso 0 dist 8.94847 5.5851 6.04753 8.9912 9.31814 4.63351 numMergedOcc 0
12 mol 103 unq 0 iso 0 dist 9.66944 5.72494 4.37349 7.85115 15.8357 11.4876 numMergedOcc 0
13 mol 103 unq 1 iso 0 dist 9.66944 8.70106 9.29681 7.85115 15.8357 11.2795 numMergedOcc 0
14 mol 182 unq 0 iso 0 dist 8.86262 7.03216 10.4612 8.43599 10.0547 5.28013 numMergedOcc 0
15 mol 182 unq 1 iso 0 dist 8.86262 9.42196 13.4338 8.43599 10.0547 5.89583 numMergedOcc 0
16 mol 182 unq 2 iso 0 dist 7.23874 7.03216 5.3582 8.43599 3.51217 5.28013 numMergedOcc 0
17 mol 182 unq 3 iso 0 dist 7.23874 9.42196 8.2857 8.43599 3.51217 5.89583 numMergedOcc 0
18 mol 192 unq 0 iso 0 dist 8.54623 5.99974 10.6534 7.20524 10.2993 5.27339 numMergedOcc 0
19 mol 192 unq 1 iso 0 dist 9.44978 9.67207 12.9784 8.42665 9.80412 9.82858 numMergedOcc 0
20 mol 204 unq 0 iso 0 dist 6.13127 9.3369 8.75176 8.50234 7.73968 6.40044 numMergedOcc 0
21 mol 283 unq 0 iso 0 dist 9.72248 8.07626 9.94666 8.3831 6.30031 9.07999 numMergedOcc 0
22 mol 283 unq 1 iso 0 dist 9.72248 8.07626 9.94666 8.44179 8.78323 5.0232 numMergedOcc 0
23 mol 283 unq 2 iso 0 dist 9.72248 6.3448 12.098 8.3831 6.30031 7.39416 numMergedOcc 0
24 mol 283 unq 3 iso 0 dist 9.72248 6.3448 12.098 8.44179 8.78323 5.78526 numMergedOcc 0
25 mol 284 unq 0 iso 0 dist 7.41633 5.62295 12.6047 4.69611 5.88619 8.4652 numMergedOcc 0
26 mol 284 unq 1 iso 0 dist 5.52837 5.62295 10.936 4.69611 4.57529 8.4652 numMergedOcc 0
27 mol 284 unq 2 iso 0 dist 6.73163 5.62295 10.1049 4.69611 5.2614 8.4652 numMergedOcc 0
28 mol 287 unq 0 iso 0 dist 6.81636 4.66252 4.76371 8.08382 11.4589 12.1302 numMergedOcc 0
29 mol 288 unq 0 iso 0 dist 6.81636 4.66252 4.76371 8.08382 11.4589 12.1302 numMergedOcc 0
30 mol 289 unq 0 iso 0 dist 6.81636 4.66252 4.76371 8.08382 11.4589 12.1302 numMergedOcc 0
