0 mol 7 unq 0 iso 0 dist 7.38748 6.22892 5.0893 16.4559 9.5325 11.8684 numMergedOcc 0
1 mol 33 unq 0 iso 0 dist 8.37901 5.66319 7.83082 6.24385 8.7979 8.00177 numMergedOcc 0
2 mol 53 unq 0 iso 0 dist 6.70095 8.94173 7.7232 8.60221 8.17003 14.3578 numMergedOcc 0
3 mol 69 unq 0 iso 0 dist 7.03224 9.68285 5.59952 8.63814 8.77132 13.7872 numMergedOcc 0
4 mol 69 unq 1 iso 0 dist 7.03224 8.31114 4.33228 8.63814 8.77132 12.1898 numMergedOcc 0
5 mol 71 unq 0 iso 0 dist 8.92529 8.21553 6.10737 5.15022 9.73011 11.0406 numMergedOcc 0
6 mol 71 unq 1 iso 0 dist 8.92529 8.22762 6.78097 5.15022 9.73011 11.8641 numMergedOcc 0
7 mol 109 unq 0 iso 0 dist 8.53914 7.4371 9.09837 4.36531 8.80233 11.3185 numMergedOcc 0
8 mol 109 unq 1 iso 0 dist 8.53914 7.4371 9.09837 5.02505 8.71813 8.67766 numMergedOcc 0
9 mol 162 unq 0 iso 0 dist 6.59407 9.42819 9.00663 6.62679 9.27256 15.3135 numMergedOcc 0
10 mol 162 unq 1 iso 0 dist 7.30751 8.15223 7.87851 7.2417 8.6792 10.2863 numMergedOcc 0
11 mol 214 unq 0 iso 0 dist 4.36421 7.77535 7.98893 4.08418 5.96047 7.05523 numMergedOcc 0
12 mol 214 unq 1 iso 0 dist 7.82201 9.40003 17.1162 12.7796 9.20514 20.4702 numMergedOcc 0
13 mol 214 unq 2 iso 0 dist 5.86911 9.4835 13.1789 9.28162 9.20514 16.7013 numMergedOcc 0
14 mol 220 unq 0 iso 0 dist 6.39087 7.30244 12.2765 8.88074 7.4083 15.0657 numMergedOcc 0
15 mol 220 unq 1 iso 0 dist 6.39087 7.29796 13.2427 8.88074 7.4083 15.5182 numMergedOcc 0
16 mol 220 unq 2 iso 0 dist 9.86144 9.58343 12.2765 7.46247 7.4083 15.0657 numMergedOcc 0
17 mol 220 unq 3 iso 0 dist 8.57174 8.9077 13.8822 7.92534 8.19109 15.5985 numMergedOcc 0
18 mol 223 unq 0 iso 0 dist 6.97426 9.94212 15.9255 7.84356 8.51763 15.038 numMergedOcc 0
19 mol 223 unq 1 iso 0 dist 6.97426 7.34316 8.64175 7.84356 8.51763 14.4359 numMergedOcc 0
20 mol 223 unq 2 iso 0 dist 8.87456 9.94212 17.7343 7.84356 5.57309 15.038 numMergedOcc 0
21 mol 223 unq 3 iso 0 dist 8.87456 7.34316 12.9895 7.84356 5.57309 14.4359 numMergedOcc 0
22 mol 228 unq 0 iso 0 dist 9.9685 9.29603 11.0679 13.0958 9.17729 18.9283 numMergedOcc 0
23 mol 230 unq 0 iso 0 dist 9.24729 8.33847 12.2372 5.02022 6.86851 6.41286 numMergedOcc 0
24 mol 236 unq 0 iso 0 dist 8.63249 9.97357 13.6195 7.05684 5.6241 11.9847 numMergedOcc 0
25 mol 236 unq 1 iso 0 dist 8.63249 6.36941 7.45579 7.05684 5.6241 8.50331 numMergedOcc 0
26 mol 236 unq 2 iso 0 dist 7.74348 9.96011 13.0929 10.151 5.6241 18.0067 numMergedOcc 0
27 mol 240 unq 0 iso 0 dist 7.19218 6.83069 5.36005 8.30926 8.67485 9.47583 numMergedOcc 0
28 mol 240 unq 1 iso 0 dist 7.19218 9.30995 4.4564 8.30926 8.67485 8.44909 numMergedOcc 0
29 mol 258 unq 0 iso 0 dist 8.57274 8.55181 5.80854 11.1831 8.35413 13.6004 numMergedOcc 0
30 mol 281 unq 0 iso 0 dist 6.58925 9.48968 9.49279 6.7978 9.76311 14.2379 numMergedOcc 0
