0 mol 8 unq 0 iso 0 dist 8.80278 6.27477 13.4423 7.55301 15.8658 8.99126 numMergedOcc 0
1 mol 8 unq 1 iso 0 dist 8.73998 6.27477 5.95251 7.55301 5.46588 8.99126 numMergedOcc 0
2 mol 42 unq 0 iso 0 dist 6.30589 7.06199 7.29621 6.56884 11.2603 7.41857 numMergedOcc 0
3 mol 59 unq 0 iso 0 dist 5.8166 8.97292 6.34748 9.55542 10.5678 6.71911 numMergedOcc 0
4 mol 59 unq 1 iso 0 dist 6.47468 8.97292 13.0793 9.55542 15.449 6.71911 numMergedOcc 0
5 mol 86 unq 0 iso 0 dist 9.59708 7.26032 6.51657 11.9674 13.6852 7.79359 numMergedOcc 0
6 mol 86 unq 1 iso 0 dist 7.18799 7.26032 5.19926 11.9674 10.8021 7.79359 numMergedOcc 0
7 mol 86 unq 2 iso 0 dist 8.4254 5.49793 5.19926 4.51657 10.8021 7.79359 numMergedOcc 0
8 mol 100 unq 0 iso 0 dist 9.52282 5.09688 6.89762 10.6273 6.0026 8.72704 numMergedOcc 0
9 mol 114 unq 0 iso 0 dist 5.66196 5.87387 5.24877 6.2394 11.3006 8.71128 numMergedOcc 0
10 mol 114 unq 1 iso 0 dist 5.66196 6.06543 8.47567 6.2394 11.3006 7.52743 numMergedOcc 0
11 mol 127 unq 0 iso 0 dist 9.57623 9.79448 8.89539 11.8721 10.9741 8.59981 numMergedOcc 0
12 mol 127 unq 1 iso 0 dist 9.57623 9.79448 8.89539 11.5439 15.4483 7.34519 numMergedOcc 0
13 mol 131 unq 0 iso 0 dist 8.95717 9.69757 15.665 12.4356 19.3353 8.6243 numMergedOcc 0
14 mol 132 unq 0 iso 0 dist 7.14447 9.0339 11.6877 9.29705 14.6742 6.03703 numMergedOcc 0
15 mol 132 unq 1 iso 0 dist 7.14447 8.48641 11.8999 9.29705 14.6742 7.61505 numMergedOcc 0
16 mol 134 unq 0 iso 0 dist 8.2872 6.99089 7.46245 15.1358 13.1565 8.6355 numMergedOcc 0
17 mol 167 unq 0 iso 0 dist 6.5782 6.64164 6.43506 6.90242 11.0314 8.62646 numMergedOcc 0
18 mol 182 unq 0 iso 0 dist 7.03216 6.31492 9.72559 5.37421 12.0424 6.73313 numMergedOcc 0
19 mol 182 unq 1 iso 0 dist 9.42196 6.31492 13.9897 5.37421 11.6684 6.73313 numMergedOcc 0
20 mol 187 unq 0 iso 0 dist 5.26804 7.68247 4.98423 4.8403 7.9625 9.27478 numMergedOcc 0
21 mol 227 unq 0 iso 0 dist 9.09371 6.18486 8.98613 5.31715 11.7694 8.83563 numMergedOcc 0
22 mol 238 unq 0 iso 0 dist 7.00773 9.82174 9.4693 12.5765 15.1787 6.91569 numMergedOcc 0
23 mol 253 unq 0 iso 0 dist 8.27377 7.0247 12.8819 3.494 11.3493 7.19465 numMergedOcc 0
24 mol 266 unq 0 iso 0 dist 9.64366 9.27588 8.81953 10.1704 12.8532 9.02188 numMergedOcc 0
25 mol 282 unq 0 iso 0 dist 7.28238 7.90792 7.94567 6.63358 11.4162 7.32347 numMergedOcc 0
26 mol 282 unq 1 iso 0 dist 7.3389 7.90792 11.2762 6.63358 7.10557 7.32347 numMergedOcc 0
27 mol 284 unq 0 iso 0 dist 9.75137 9.26573 10.6793 13.5055 12.476 8.41504 numMergedOcc 0
28 mol 292 unq 0 iso 0 dist 9.20553 6.8133 9.63504 8.10093 15.4395 9.454 numMergedOcc 0
29 mol 293 unq 0 iso 0 dist 6.02106 8.90008 8.15525 11.8919 12.799 8.56847 numMergedOcc 0
30 mol 293 unq 1 iso 0 dist 8.27274 8.90008 9.35524 11.8919 10.0258 8.56847 numMergedOcc 0
31 mol 294 unq 0 iso 0 dist 9.2924 7.1984 6.6414 6.28374 8.05845 9.03492 numMergedOcc 0
