0 mol 7 unq 0 iso 0 dist 7.15434 11.2706 7.10621 16.3188 10.789 7.31201 13.6482 7.12508 6.1206 4.40641 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 7.15434 11.2706 7.10621 16.3188 10.789 7.31201 17.5841 11.143 7.67927 5.03278 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 7.15434 11.2706 7.10621 13.7477 10.515 9.36807 13.6482 7.12508 6.1206 7.92429 numMergedOcc 0
3 mol 7 unq 3 iso 0 dist 7.15434 11.2706 7.10621 13.7477 10.515 9.36807 17.5841 11.143 7.67927 11.2233 numMergedOcc 0
4 mol 72 unq 0 iso 0 dist 6.68311 15.0607 9.96708 14.0266 9.0131 7.321 12.0518 5.69391 9.55118 6.74416 numMergedOcc 0
5 mol 72 unq 1 iso 0 dist 6.68311 15.0607 9.96708 14.0266 9.0131 7.321 19.2494 13.4212 9.10345 5.63793 numMergedOcc 0
6 mol 72 unq 2 iso 0 dist 6.7212 11.6369 9.96708 11.9031 7.11552 6.77912 8.16985 7.47371 7.12321 9.88768 numMergedOcc 0
7 mol 72 unq 3 iso 0 dist 6.7212 6.12361 9.78528 10.8529 11.6894 9.02278 8.16985 7.47371 6.21799 5.5067 numMergedOcc 0
8 mol 72 unq 4 iso 0 dist 6.7212 6.12361 9.78528 10.8529 11.6894 9.02278 7.81344 9.67587 5.03251 4.01021 numMergedOcc 0
9 mol 72 unq 5 iso 0 dist 6.7212 6.12361 9.78528 10.8529 11.6894 9.02278 5.49421 7.07356 7.66093 6.40102 numMergedOcc 0
10 mol 100 unq 0 iso 0 dist 8.96916 5.92158 6.45675 12.237 7.2495 8.72704 8.38273 5.43561 7.82475 12.5061 numMergedOcc 0
11 mol 100 unq 1 iso 0 dist 8.96916 5.92158 6.45675 12.237 7.2495 8.72704 5.30117 6.30222 5.35782 12.1093 numMergedOcc 0
12 mol 100 unq 2 iso 0 dist 5.70279 5.92158 7.47343 12.237 10.1589 8.72704 8.38273 5.9143 7.82475 12.5061 numMergedOcc 0
13 mol 100 unq 3 iso 0 dist 5.70279 5.92158 7.47343 12.237 10.1589 8.72704 5.30117 5.47563 5.35782 12.1093 numMergedOcc 0
14 mol 115 unq 0 iso 0 dist 8.97043 11.8721 9.33865 15.3564 10.7942 7.76729 13.829 6.95773 6.24825 5.78043 numMergedOcc 0
15 mol 117 unq 0 iso 0 dist 8.81172 5.34484 9.84395 11.3437 11.3679 6.62561 8.54233 6.57678 6.10127 6.95589 numMergedOcc 0
16 mol 142 unq 0 iso 0 dist 7.15087 8.68855 9.2313 9.15112 9.49653 7.15475 5.90339 4.67662 7.81207 5.26247 numMergedOcc 0
17 mol 142 unq 1 iso 0 dist 7.15087 8.68855 9.2313 9.15112 9.49653 7.15475 15.501 13.5913 7.18002 12.2806 numMergedOcc 0
18 mol 142 unq 2 iso 0 dist 7.15087 5.50176 5.31024 9.15112 9.49653 9.07935 5.90339 4.67662 6.14151 5.26247 numMergedOcc 0
19 mol 155 unq 0 iso 0 dist 5.68636 7.92939 6.43582 16.0761 12.1814 9.14392 8.14405 4.91785 8.97626 12.0485 numMergedOcc 0
20 mol 155 unq 1 iso 0 dist 5.68636 7.92939 6.43582 10.6429 6.34186 7.51198 8.14405 4.91785 8.97626 4.48516 numMergedOcc 0
21 mol 205 unq 0 iso 0 dist 6.15806 10.6362 7.26832 7.70781 6.23291 9.19704 16.3573 13.514 6.52816 13.4094 numMergedOcc 0
22 mol 224 unq 0 iso 0 dist 9.73411 9.81806 6.57273 14.0429 5.29877 6.65984 5.31916 7.05804 8.79428 10.9705 numMergedOcc 0
23 mol 224 unq 1 iso 0 dist 7.07564 10.8463 6.57273 10.7344 5.29877 6.65984 11.6723 7.05804 8.79428 10.9705 numMergedOcc 0
24 mol 259 unq 0 iso 0 dist 8.57619 5.43184 5.30224 11.4829 4.99891 6.77938 9.2885 4.04513 8.03219 8.90322 numMergedOcc 0
25 mol 259 unq 1 iso 0 dist 8.57619 5.43184 5.30224 11.4829 4.99891 6.77938 10.5384 7.09907 6.9899 9.2872 numMergedOcc 0
26 mol 259 unq 2 iso 0 dist 8.57619 5.43184 5.30224 12.2858 5.32839 7.76676 9.2885 4.04513 8.03219 7.27192 numMergedOcc 0
27 mol 259 unq 3 iso 0 dist 8.57619 5.43184 5.30224 12.2858 5.32839 7.76676 10.5384 7.09907 6.9899 4.61451 numMergedOcc 0
28 mol 276 unq 0 iso 0 dist 8.79189 6.33662 6.87396 13.3054 6.4102 8.76347 8.51449 8.26321 8.6759 13.5196 numMergedOcc 0
