0 mol 2 unq 0 iso 0 dist 7.29506 10.0503 6.89072 8.54182 4.00237 5.42021 numMergedOcc 0
1 mol 10 unq 0 iso 0 dist 9.10885 9.60284 8.44792 16.3594 14.4547 9.56259 numMergedOcc 0
2 mol 17 unq 0 iso 0 dist 8.62221 5.04858 4.64234 12.2587 7.07645 9.43863 numMergedOcc 0
3 mol 17 unq 1 iso 0 dist 9.84476 5.04858 6.26254 12.2587 3.94012 9.43863 numMergedOcc 0
4 mol 46 unq 0 iso 0 dist 9.942 5.79552 8.79378 8.99557 6.54685 9.47718 numMergedOcc 0
5 mol 46 unq 1 iso 0 dist 9.942 14.6072 9.7691 8.99557 6.54685 8.9459 numMergedOcc 0
6 mol 59 unq 0 iso 0 dist 8.90147 9.53452 4.90216 6.17977 4.82623 5.81747 numMergedOcc 0
7 mol 59 unq 1 iso 0 dist 8.90147 9.53452 4.90216 9.95695 6.24283 6.81975 numMergedOcc 0
8 mol 59 unq 2 iso 0 dist 6.9741 3.98162 4.90216 6.83083 4.82623 5.81747 numMergedOcc 0
9 mol 59 unq 3 iso 0 dist 6.9741 3.98162 4.90216 9.37896 6.24283 6.81975 numMergedOcc 0
10 mol 59 unq 4 iso 0 dist 7.92225 15.8839 9.34271 13.1384 5.96516 4.67917 numMergedOcc 0
11 mol 59 unq 5 iso 0 dist 7.92225 15.8839 9.34271 13.1034 7.53537 5.81747 numMergedOcc 0
12 mol 120 unq 0 iso 0 dist 8.93999 6.80253 8.03124 7.61244 3.71884 8.43293 numMergedOcc 0
13 mol 123 unq 0 iso 0 dist 8.09329 7.43229 8.30974 14.1698 11.1908 8.71274 numMergedOcc 0
14 mol 123 unq 1 iso 0 dist 6.13025 7.19969 8.30974 11.6775 11.1908 8.71274 numMergedOcc 0
15 mol 168 unq 0 iso 0 dist 6.24232 10.8619 6.48066 10.6438 7.13766 9.76722 numMergedOcc 0
16 mol 168 unq 1 iso 0 dist 8.1953 12.8199 6.48066 11.7646 7.13766 9.76722 numMergedOcc 0
17 mol 169 unq 0 iso 0 dist 9.03941 13.2649 7.50458 12.3346 3.69097 8.44483 numMergedOcc 0
18 mol 169 unq 1 iso 0 dist 9.03941 13.2649 7.50458 20.2534 11.5623 9.79864 numMergedOcc 0
19 mol 169 unq 2 iso 0 dist 9.03941 13.2649 7.50458 22.8455 16.721 9.73241 numMergedOcc 0
20 mol 169 unq 3 iso 0 dist 8.80004 11.1188 7.78577 9.33102 4.24401 8.44483 numMergedOcc 0
21 mol 171 unq 0 iso 0 dist 8.25547 7.58118 7.06555 11.8931 14.5273 8.59783 numMergedOcc 0
22 mol 210 unq 0 iso 0 dist 9.72463 17.8528 9.49242 22.2684 12.6983 9.718 numMergedOcc 0
23 mol 210 unq 1 iso 0 dist 9.72463 17.8528 9.49242 18.4811 9.16249 8.61629 numMergedOcc 0
24 mol 214 unq 0 iso 0 dist 9.71467 4.34226 9.68612 10.7893 6.62122 8.80167 numMergedOcc 0
25 mol 214 unq 1 iso 0 dist 6.03628 7.73947 9.68612 6.99667 6.62122 8.80167 numMergedOcc 0
26 mol 237 unq 0 iso 0 dist 5.27463 5.61195 7.69237 9.66939 6.51804 7.66306 numMergedOcc 0
27 mol 285 unq 0 iso 0 dist 6.94666 6.61129 6.73396 9.8873 5.00843 8.12306 numMergedOcc 0
28 mol 294 unq 0 iso 0 dist 6.70519 9.32871 7.48987 13.0466 11.5334 8.89372 numMergedOcc 0
