0 mol 1 unq 0 iso 0 dist 9.34725 9.30501 11.96 7.16224 8.69605 13.5303 numMergedOcc 0
1 mol 14 unq 0 iso 0 dist 9.24546 7.79091 5.82278 10.495 7.59564 8.10957 numMergedOcc 0
2 mol 14 unq 1 iso 0 dist 7.79091 9.24546 5.82278 10.495 8.10957 7.59564 numMergedOcc 0
3 mol 17 unq 0 iso 0 dist 7.96836 8.49309 11.1609 5.21083 7.34681 12.5763 numMergedOcc 0
4 mol 87 unq 0 iso 0 dist 9.99609 7.08616 15.2271 12.809 9.90256 16.7109 numMergedOcc 0
5 mol 87 unq 1 iso 0 dist 9.99609 7.08616 15.2271 8.37496 7.57471 14.4469 numMergedOcc 0
6 mol 87 unq 2 iso 0 dist 9.99609 7.83182 12.4211 12.809 9.90256 12.0487 numMergedOcc 0
7 mol 87 unq 3 iso 0 dist 9.99609 7.83182 12.4211 8.37496 7.57471 11.9046 numMergedOcc 0
8 mol 87 unq 4 iso 0 dist 4.58684 5.87044 5.08355 5.79354 6.22441 9.67933 numMergedOcc 0
9 mol 87 unq 5 iso 0 dist 4.58684 6.90348 5.78586 5.79354 6.22441 5.91543 numMergedOcc 0
10 mol 87 unq 6 iso 0 dist 6.90348 5.87044 6.47413 5.79354 5.91543 9.67933 numMergedOcc 0
11 mol 87 unq 7 iso 0 dist 6.90348 4.58684 5.78586 5.79354 5.91543 6.22441 numMergedOcc 0
12 mol 103 unq 0 iso 0 dist 7.68908 7.95587 4.59488 6.35861 7.66418 9.97835 numMergedOcc 0
13 mol 103 unq 1 iso 0 dist 7.68908 7.95587 4.59488 5.56761 8.078 10.844 numMergedOcc 0
14 mol 116 unq 0 iso 0 dist 9.09071 7.7367 4.48374 5.73517 6.53824 6.61973 numMergedOcc 0
15 mol 116 unq 1 iso 0 dist 7.7367 9.09071 4.48374 5.73517 6.61973 6.53824 numMergedOcc 0
16 mol 167 unq 0 iso 0 dist 6.26373 8.94308 9.71654 4.72853 7.20545 12.2548 numMergedOcc 0
17 mol 167 unq 1 iso 0 dist 6.26373 9.74227 12.6725 4.72853 7.20545 12.8904 numMergedOcc 0
18 mol 203 unq 0 iso 0 dist 9.52542 9.58178 5.73409 10.3525 6.84619 11.2429 numMergedOcc 0
19 mol 203 unq 1 iso 0 dist 9.80432 9.75662 10.3042 12.8357 6.84619 16.2069 numMergedOcc 0
20 mol 203 unq 2 iso 0 dist 9.80432 6.86448 9.7657 12.8357 6.84619 14.0247 numMergedOcc 0
21 mol 211 unq 0 iso 0 dist 8.74044 8.14513 15.6302 6.11238 8.10779 11.3087 numMergedOcc 0
22 mol 211 unq 1 iso 0 dist 8.74044 8.14513 15.6302 7.33323 5.6998 15.0255 numMergedOcc 0
23 mol 220 unq 0 iso 0 dist 9.92349 9.70779 11.0459 11.12 5.25149 8.6368 numMergedOcc 0
24 mol 220 unq 1 iso 0 dist 9.70779 9.92349 11.0459 11.12 8.6368 5.25149 numMergedOcc 0
25 mol 272 unq 0 iso 0 dist 8.56255 4.87063 4.96666 13.1454 6.69245 11.16 numMergedOcc 0
26 mol 272 unq 1 iso 0 dist 8.56255 4.87063 4.96666 13.7982 7.90763 11.2624 numMergedOcc 0
27 mol 287 unq 0 iso 0 dist 9.40407 9.71269 12.5877 9.16384 8.40726 16.6513 numMergedOcc 0
28 mol 288 unq 0 iso 0 dist 9.40407 9.71269 12.5877 9.16384 8.40726 16.6513 numMergedOcc 0
29 mol 289 unq 0 iso 0 dist 9.40407 9.71269 12.5877 9.16384 8.40726 16.6513 numMergedOcc 0
