0 mol 24 unq 0 iso 0 dist 8.56483 8.23069 8.70827 6.272 8.67426 13.0224 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 8.56483 8.59466 9.12854 6.272 8.67426 10.0711 numMergedOcc 0
2 mol 85 unq 0 iso 0 dist 5.20528 9.53239 9.82915 6.53227 8.04853 11.9949 numMergedOcc 0
3 mol 85 unq 1 iso 0 dist 5.20528 9.53239 9.82915 3.93024 6.46549 13.3089 numMergedOcc 0
4 mol 109 unq 0 iso 0 dist 4.76028 4.85247 7.02927 4.42089 5.54226 4.56372 numMergedOcc 0
5 mol 113 unq 0 iso 0 dist 8.49444 12.9469 8.8822 6.04365 7.40338 15.3211 numMergedOcc 0
6 mol 113 unq 1 iso 0 dist 5.55446 12.9469 9.66219 3.71942 5.35711 13.0914 numMergedOcc 0
7 mol 113 unq 2 iso 0 dist 5.55446 12.9469 9.66219 6.04365 6.23759 15.3211 numMergedOcc 0
8 mol 135 unq 0 iso 0 dist 5.95344 5.52034 5.62052 5.87899 8.72359 3.78012 numMergedOcc 0
9 mol 135 unq 1 iso 0 dist 5.95344 5.52034 5.62052 10.9982 7.02963 10.9403 numMergedOcc 0
10 mol 135 unq 2 iso 0 dist 5.95344 9.8859 7.85645 5.87899 8.72359 9.62654 numMergedOcc 0
11 mol 135 unq 3 iso 0 dist 5.95344 9.8859 7.85645 10.9982 7.02963 8.06169 numMergedOcc 0
12 mol 135 unq 4 iso 0 dist 7.8687 9.8231 5.62052 11.0453 8.72359 3.78012 numMergedOcc 0
13 mol 135 unq 5 iso 0 dist 7.8687 9.8231 5.62052 8.95563 7.02963 10.9403 numMergedOcc 0
14 mol 135 unq 6 iso 0 dist 7.8687 10.955 7.85645 11.0453 8.72359 9.62654 numMergedOcc 0
15 mol 135 unq 7 iso 0 dist 7.8687 10.955 7.85645 8.95563 7.02963 8.06169 numMergedOcc 0
16 mol 146 unq 0 iso 0 dist 6.4477 5.1208 8.84535 9.05929 5.95148 10.4935 numMergedOcc 0
17 mol 146 unq 1 iso 0 dist 6.4477 8.91039 8.82188 9.05929 5.95148 4.19745 numMergedOcc 0
18 mol 146 unq 2 iso 0 dist 7.92203 9.57404 8.84535 6.43443 5.95148 10.4935 numMergedOcc 0
19 mol 146 unq 3 iso 0 dist 7.92203 5.03943 8.82188 6.43443 5.95148 4.19745 numMergedOcc 0
20 mol 184 unq 0 iso 0 dist 6.71675 4.59843 6.42735 9.24858 7.02762 5.03539 numMergedOcc 0
21 mol 198 unq 0 iso 0 dist 9.75046 7.74458 6.34616 6.88195 8.78623 4.27652 numMergedOcc 0
22 mol 198 unq 1 iso 0 dist 6.73371 5.21925 6.34616 5.73959 8.78623 4.27652 numMergedOcc 0
23 mol 205 unq 0 iso 0 dist 6.32542 9.40714 6.03688 3.30102 5.59832 6.49049 numMergedOcc 0
24 mol 205 unq 1 iso 0 dist 6.79634 4.84308 5.44002 7.82495 7.13824 4.30308 numMergedOcc 0
25 mol 213 unq 0 iso 0 dist 9.65238 7.18317 7.37798 10.9151 9.34602 4.71943 numMergedOcc 0
26 mol 235 unq 0 iso 0 dist 7.90349 6.19292 8.69356 5.7279 8.73715 3.99115 numMergedOcc 0
27 mol 274 unq 0 iso 0 dist 6.74022 10.7073 8.52587 3.47588 8.09181 12.5154 numMergedOcc 0
28 mol 274 unq 1 iso 0 dist 6.74022 6.45522 6.39866 3.47588 8.09181 4.60007 numMergedOcc 0
29 mol 280 unq 0 iso 0 dist 9.35785 10.6459 9.76787 12.2584 9.47429 4.51188 numMergedOcc 0
30 mol 287 unq 0 iso 0 dist 8.25538 11.7745 6.89451 12.1947 7.99204 4.21609 numMergedOcc 0
31 mol 288 unq 0 iso 0 dist 8.25538 11.7745 6.89451 12.1947 7.99204 4.21609 numMergedOcc 0
32 mol 289 unq 0 iso 0 dist 8.25538 11.7745 6.89451 12.1947 7.99204 4.21609 numMergedOcc 0
