0 mol 5 unq 0 iso 0 dist 5.14917 5.43606 7.15734 6.13766 6.93063 10.0814 numMergedOcc 0
1 mol 5 unq 1 iso 0 dist 5.14917 5.43606 7.15734 7.8254 7.86627 9.58245 numMergedOcc 0
2 mol 6 unq 0 iso 0 dist 6.47003 7.94377 8.92565 5.83727 5.8726 11.2086 numMergedOcc 0
3 mol 69 unq 0 iso 0 dist 9.00405 6.73658 7.09393 7.22813 9.24557 11.5139 numMergedOcc 0
4 mol 69 unq 1 iso 0 dist 9.00405 6.55166 3.87167 7.22813 9.24557 8.73219 numMergedOcc 0
5 mol 69 unq 2 iso 0 dist 5.06756 6.60542 7.09393 5.60027 9.24557 11.5139 numMergedOcc 0
6 mol 69 unq 3 iso 0 dist 5.06756 3.36421 3.87167 5.60027 9.24557 8.73219 numMergedOcc 0
7 mol 123 unq 0 iso 0 dist 8.56386 14.7054 9.86842 14.4087 8.74958 12.8839 numMergedOcc 0
8 mol 127 unq 0 iso 0 dist 5.52891 3.94367 8.98151 9.21978 7.34368 11.2884 numMergedOcc 0
9 mol 163 unq 0 iso 0 dist 8.66172 10.2273 9.85967 7.55428 6.35103 9.38747 numMergedOcc 0
10 mol 165 unq 0 iso 0 dist 9.8446 9.75412 9.59989 12.0001 4.46402 11.4693 numMergedOcc 0
11 mol 173 unq 0 iso 0 dist 8.84813 4.23524 5.97008 8.53917 7.90789 8.51683 numMergedOcc 0
12 mol 173 unq 1 iso 0 dist 8.84813 4.23524 5.97008 9.00436 4.13397 8.00155 numMergedOcc 0
13 mol 186 unq 0 iso 0 dist 5.83898 8.56706 9.08767 7.19985 7.62128 14.8895 numMergedOcc 0
14 mol 220 unq 0 iso 0 dist 8.55805 12.6024 7.35148 8.78097 8.01243 5.72234 numMergedOcc 0
15 mol 220 unq 1 iso 0 dist 8.55805 12.6024 7.35148 16.8623 9.55264 13.2318 numMergedOcc 0
16 mol 223 unq 0 iso 0 dist 7.29418 5.59816 6.03408 12.9644 9.0935 12.0768 numMergedOcc 0
17 mol 223 unq 1 iso 0 dist 8.63099 4.04961 6.03408 15.0057 9.0935 12.0768 numMergedOcc 0
18 mol 254 unq 0 iso 0 dist 8.76115 5.24816 7.53352 15.1696 8.5291 12.5167 numMergedOcc 0
19 mol 254 unq 1 iso 0 dist 8.76115 5.24816 7.53352 17.6322 9.32852 16.0777 numMergedOcc 0
20 mol 254 unq 2 iso 0 dist 8.76115 9.11887 7.80793 15.1696 8.5291 8.03226 numMergedOcc 0
21 mol 254 unq 3 iso 0 dist 8.76115 9.11887 7.80793 17.6322 9.32852 13.263 numMergedOcc 0
22 mol 265 unq 0 iso 0 dist 9.81689 12.7023 9.50814 9.77191 7.29987 5.87866 numMergedOcc 0
23 mol 266 unq 0 iso 0 dist 7.66705 4.90213 5.28417 7.06577 9.80706 5.6764 numMergedOcc 0
24 mol 280 unq 0 iso 0 dist 7.78355 10.0698 6.83927 15.3259 9.94082 8.23689 numMergedOcc 0
25 mol 280 unq 1 iso 0 dist 7.78355 10.0698 6.83927 13.8971 9.9882 5.63061 numMergedOcc 0
