0 mol 129 unq 0 iso 0 dist 8.63018 5.0466 7.07421 5.56946 6.29026 4.80675 6.65878 5.06265 7.6453 8.00624 numMergedOcc 0
1 mol 133 unq 0 iso 0 dist 6.85651 8.75242 9.07294 4.84607 8.84018 13.1243 6.9268 5.35551 5.79195 9.64659 numMergedOcc 0
2 mol 133 unq 1 iso 0 dist 6.85651 14.0828 7.50126 4.84607 8.84018 15.9524 6.9268 5.35551 9.2759 9.64659 numMergedOcc 0
3 mol 133 unq 2 iso 0 dist 7.03858 6.45333 9.07294 11.981 8.84018 13.1243 8.19166 5.35551 5.79195 9.64659 numMergedOcc 0
4 mol 133 unq 3 iso 0 dist 7.03858 11.5586 7.50126 11.981 8.84018 15.9524 8.19166 5.35551 9.2759 9.64659 numMergedOcc 0
5 mol 226 unq 0 iso 0 dist 8.10096 6.92911 7.20862 5.47434 9.5723 10.5706 15.606 12.3908 8.74399 18.3138 numMergedOcc 0
6 mol 241 unq 0 iso 0 dist 8.15897 6.70277 9.174 9.87799 9.72526 7.93809 12.5814 10.9643 7.26758 12.8359 numMergedOcc 0
7 mol 258 unq 0 iso 0 dist 9.4886 12.1075 8.57305 11.9201 5.81927 6.51074 11.4159 5.00751 6.33567 7.69358 numMergedOcc 0
8 mol 258 unq 1 iso 0 dist 9.4886 12.1075 8.57305 8.27707 6.09782 5.57797 11.4159 5.00751 6.33567 7.57187 numMergedOcc 0
9 mol 259 unq 0 iso 0 dist 5.22111 6.92619 4.55368 5.41945 7.93997 6.18571 11.0717 6.14631 8.54422 13.119 numMergedOcc 0
10 mol 259 unq 1 iso 0 dist 5.22111 6.92619 4.55368 5.41945 7.93997 6.18571 10.5924 6.89689 7.67473 10.895 numMergedOcc 0
11 mol 259 unq 2 iso 0 dist 8.53598 11.3266 4.55368 10.2837 7.93997 6.18571 13.7519 6.14631 8.54422 13.119 numMergedOcc 0
12 mol 259 unq 3 iso 0 dist 8.53598 11.3266 4.55368 10.2837 7.93997 6.18571 14.6605 6.89689 7.67473 10.895 numMergedOcc 0
13 mol 265 unq 0 iso 0 dist 8.22353 5.62902 9.50814 7.73011 9.72927 6.35501 8.01664 3.89234 7.52632 6.45326 numMergedOcc 0
14 mol 274 unq 0 iso 0 dist 7.62562 10.4456 6.12202 6.96875 7.79904 5.7574 16.7249 10.3702 9.34051 13.1113 numMergedOcc 0
15 mol 274 unq 1 iso 0 dist 7.62562 10.4456 6.12202 15.8929 9.02749 7.23876 16.7249 10.3702 9.34051 8.88221 numMergedOcc 0
16 mol 277 unq 0 iso 0 dist 7.52227 9.59994 8.81903 5.58906 6.60309 5.28949 9.78915 4.81768 8.04712 6.03235 numMergedOcc 0
17 mol 283 unq 0 iso 0 dist 7.90132 5.37953 7.53773 4.44211 9.53225 4.69801 12.7983 6.85055 9.243 12.4981 numMergedOcc 0
