0 mol 7 unq 0 iso 0 dist 8.57437 10.0257 9.67498 17.7278 9.85726 15.0231 18.947 10.4879 17.8527 7.32392 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 8.57437 9.33944 9.32945 17.7278 9.85726 17.302 18.947 10.4879 15.7555 7.32392 numMergedOcc 0
2 mol 14 unq 0 iso 0 dist 9.42142 5.06934 7.66311 5.63648 8.39221 4.15151 10.9956 6.09608 8.88058 6.89209 numMergedOcc 0
3 mol 16 unq 0 iso 0 dist 9.56648 10.143 7.88676 10.1011 8.67719 6.06561 13.8231 9.57729 11.7065 6.84569 numMergedOcc 0
4 mol 61 unq 0 iso 0 dist 9.82315 9.53688 4.628 7.49081 5.92705 6.32949 9.91313 6.47853 10.2903 9.70415 numMergedOcc 0
5 mol 61 unq 1 iso 0 dist 9.67403 8.24748 8.30431 4.90701 9.62468 6.32949 14.542 14.0458 10.2903 9.70415 numMergedOcc 0
6 mol 61 unq 2 iso 0 dist 7.28917 14.4616 8.30431 16.7918 9.62468 6.32949 20.6191 14.0458 10.2903 9.70415 numMergedOcc 0
7 mol 109 unq 0 iso 0 dist 7.66832 9.79203 8.59182 9.47324 8.21889 12.4009 11.6716 5.07258 12.4161 7.51061 numMergedOcc 0
8 mol 109 unq 1 iso 0 dist 8.11083 5.26073 8.59182 12.7688 8.21889 12.4009 13.0316 5.07258 12.4161 7.51061 numMergedOcc 0
9 mol 238 unq 0 iso 0 dist 9.46728 4.13744 5.57184 11.9383 6.83152 9.76195 14.6951 7.10888 11.4755 6.06422 numMergedOcc 0
10 mol 238 unq 1 iso 0 dist 9.46728 4.13744 5.57184 9.23693 5.24313 7.01206 9.69906 12.2489 10.5902 7.64276 numMergedOcc 0
11 mol 265 unq 0 iso 0 dist 8.22353 8.39994 9.56472 7.73011 9.72927 15.3912 8.6462 4.3101 11.4757 8.57445 numMergedOcc 0
12 mol 265 unq 1 iso 0 dist 8.22353 5.62902 9.50814 7.73011 9.72927 6.35501 8.6462 4.3101 10.8833 8.57445 numMergedOcc 0
13 mol 274 unq 0 iso 0 dist 7.62562 10.4456 6.12202 15.8929 9.02749 7.23876 11.8627 4.84163 8.04439 6.36173 numMergedOcc 0
14 mol 277 unq 0 iso 0 dist 7.52227 9.59994 8.81903 5.58906 6.60309 5.28949 8.12461 5.76075 13.1115 8.82899 numMergedOcc 0
15 mol 278 unq 0 iso 0 dist 6.83278 8.84423 8.87405 13.5373 9.82774 8.66976 20.1796 14.331 16.7318 8.83775 numMergedOcc 0
