0 mol 46 unq 0 iso 0 dist 7.32126 9.30547 4.19866 13.9221 10.2002 8.55202 numMergedOcc 0
1 mol 73 unq 0 iso 0 dist 8.91717 9.60134 3.61874 8.02989 10.511 9.42184 numMergedOcc 0
2 mol 103 unq 0 iso 0 dist 8.78439 4.9418 8.55092 6.18487 12.8042 4.49975 numMergedOcc 0
3 mol 113 unq 0 iso 0 dist 8.50734 7.92498 14.4003 9.33696 12.2908 6.12348 numMergedOcc 0
4 mol 115 unq 0 iso 0 dist 9.47443 7.65299 15.8352 11.399 16.2593 8.42219 numMergedOcc 0
5 mol 141 unq 0 iso 0 dist 6.47392 8.47476 10.5086 11.0797 15.2083 5.56446 numMergedOcc 0
6 mol 154 unq 0 iso 0 dist 8.27247 5.67586 4.25621 4.78116 9.21759 5.06116 numMergedOcc 0
7 mol 154 unq 1 iso 0 dist 7.80275 5.67586 6.83168 4.78116 9.6714 5.06116 numMergedOcc 0
8 mol 169 unq 0 iso 0 dist 7.642 8.11268 11.2473 9.33941 14.7196 6.27683 numMergedOcc 0
9 mol 227 unq 0 iso 0 dist 9.6288 5.36841 7.13157 8.82656 14.6218 7.90991 numMergedOcc 0
10 mol 233 unq 0 iso 0 dist 6.59321 4.91191 5.5881 9.1334 11.2143 8.7831 numMergedOcc 0
11 mol 233 unq 1 iso 0 dist 6.59321 4.91191 5.5881 9.81222 10.1504 9.61071 numMergedOcc 0
12 mol 233 unq 2 iso 0 dist 6.59321 4.91191 5.5881 5.17683 5.29501 7.1229 numMergedOcc 0
13 mol 233 unq 3 iso 0 dist 9.80759 4.91191 11.4518 9.1334 16.7991 8.7831 numMergedOcc 0
14 mol 233 unq 4 iso 0 dist 9.80759 4.91191 11.4518 9.81222 15.4586 9.61071 numMergedOcc 0
15 mol 233 unq 5 iso 0 dist 9.80759 4.91191 11.4518 5.17683 8.81206 7.1229 numMergedOcc 0
16 mol 236 unq 0 iso 0 dist 6.35418 6.54859 7.34037 7.27242 10.8531 8.58772 numMergedOcc 0
17 mol 260 unq 0 iso 0 dist 7.5129 7.90537 11.113 9.31424 8.52702 7.27503 numMergedOcc 0
18 mol 285 unq 0 iso 0 dist 6.55498 9.33149 7.62941 12.3683 14.012 8.69325 numMergedOcc 0
19 mol 285 unq 1 iso 0 dist 6.55498 9.33149 7.62941 13.1909 11.9915 5.09181 numMergedOcc 0
20 mol 285 unq 2 iso 0 dist 7.38219 9.33149 11.4179 12.3683 15.9901 8.69325 numMergedOcc 0
21 mol 285 unq 3 iso 0 dist 7.38219 9.33149 11.4179 13.1909 15.0978 5.09181 numMergedOcc 0
