0 mol 10 unq 0 iso 0 dist 7.82875 9.69394 9.39486 10.1339 3.92592 9.43029 numMergedOcc 0
1 mol 10 unq 1 iso 0 dist 7.93277 12.2644 7.14537 9.39017 5.83346 6.18431 numMergedOcc 0
2 mol 76 unq 0 iso 0 dist 6.55112 6.38237 9.59729 11.1286 10.1364 7.46095 numMergedOcc 0
3 mol 79 unq 0 iso 0 dist 8.26763 4.0291 8.64934 5.33546 3.99035 7.43127 numMergedOcc 0
4 mol 79 unq 1 iso 0 dist 6.30814 4.0291 8.7515 5.33546 4.53016 7.43127 numMergedOcc 0
5 mol 105 unq 0 iso 0 dist 9.15226 4.59356 9.17843 8.40598 13.4342 7.77089 numMergedOcc 0
6 mol 112 unq 0 iso 0 dist 6.6536 8.8974 6.96745 10.3011 10.6938 7.67238 numMergedOcc 0
7 mol 162 unq 0 iso 0 dist 9.65468 6.82744 7.01095 12.8918 4.8427 8.33407 numMergedOcc 0
8 mol 181 unq 0 iso 0 dist 5.97971 8.70425 9.92831 12.2628 11.9796 8.06308 numMergedOcc 0
9 mol 181 unq 1 iso 0 dist 8.72747 8.28396 9.92831 14.6112 11.9796 8.06308 numMergedOcc 0
10 mol 181 unq 2 iso 0 dist 8.23845 4.60202 9.92831 11.2332 11.9796 8.06308 numMergedOcc 0
11 mol 195 unq 0 iso 0 dist 8.84149 4.3166 6.396 13.0323 5.66395 9.24936 numMergedOcc 0
12 mol 225 unq 0 iso 0 dist 8.69052 12.7959 6.46405 16.345 7.96454 9.82043 numMergedOcc 0
13 mol 225 unq 1 iso 0 dist 8.69052 12.7959 6.46405 12.6915 4.45116 8.22922 numMergedOcc 0
14 mol 227 unq 0 iso 0 dist 8.76745 8.30723 6.09335 17.097 10.5007 9.18728 numMergedOcc 0
15 mol 227 unq 1 iso 0 dist 8.76745 8.30723 6.09335 13.5381 12.8337 8.91971 numMergedOcc 0
16 mol 227 unq 2 iso 0 dist 9.34023 5.92282 8.85955 13.8669 8.62578 9.18728 numMergedOcc 0
17 mol 227 unq 3 iso 0 dist 9.34023 5.92282 8.85955 14.0842 15.624 8.91971 numMergedOcc 0
18 mol 227 unq 4 iso 0 dist 5.77762 5.92282 6.09335 13.8669 10.5007 9.18728 numMergedOcc 0
19 mol 227 unq 5 iso 0 dist 5.77762 5.92282 6.09335 14.0842 12.8337 8.91971 numMergedOcc 0
20 mol 235 unq 0 iso 0 dist 7.93194 3.89748 6.03081 12.7207 10.6687 8.97952 numMergedOcc 0
21 mol 236 unq 0 iso 0 dist 8.75172 4.58625 8.93212 5.91739 3.86189 6.15635 numMergedOcc 0
22 mol 277 unq 0 iso 0 dist 6.42951 13.1828 7.16209 9.35976 6.64795 9.26157 numMergedOcc 0
