0 mol 20 unq 0 iso 0 dist 9.4759 7.6876 15.6043 8.91975 17.1657 5.0973 9.63181 12.1337 7.81123 10.5266 numMergedOcc 0
1 mol 25 unq 0 iso 0 dist 8.41008 9.67955 16.7206 6.5461 7.24223 11.4412 9.67946 15.9786 5.77186 12.9801 numMergedOcc 0
2 mol 71 unq 0 iso 0 dist 5.75102 8.25891 10.2512 6.01135 9.02337 6.93183 5.70431 6.06105 5.86791 4.07844 numMergedOcc 0
3 mol 136 unq 0 iso 0 dist 8.06032 7.79731 11.3247 9.12669 14.8154 10.2102 9.2211 4.94273 12.1315 12.7228 numMergedOcc 0
4 mol 165 unq 0 iso 0 dist 3.87901 7.29604 6.27901 9.14728 8.46989 14.4138 8.67001 7.1886 4.91809 13.1991 numMergedOcc 0
5 mol 260 unq 0 iso 0 dist 9.94532 8.63478 13.8778 8.67447 10.1869 13.9699 6.8795 6.83989 7.1759 10.9471 numMergedOcc 0
6 mol 260 unq 1 iso 0 dist 9.94532 8.08865 10.7074 8.67447 10.1869 5.02615 6.8795 6.83989 8.60998 10.9471 numMergedOcc 0
7 mol 272 unq 0 iso 0 dist 8.89938 9.39756 15.6205 5.75554 12.2832 5.35227 8.16917 7.21193 13.0786 8.47076 numMergedOcc 0
8 mol 287 unq 0 iso 0 dist 9.11602 9.13071 11.7624 7.17626 13.3487 4.70335 8.82948 15.3271 7.26562 5.41757 numMergedOcc 0
9 mol 287 unq 1 iso 0 dist 9.11602 8.19596 5.58788 7.17626 13.3487 9.38112 8.82948 15.3271 11.1391 5.41757 numMergedOcc 0
10 mol 288 unq 0 iso 0 dist 9.11602 9.13071 11.7624 7.17626 13.3487 4.70335 8.82948 15.3271 7.26562 5.41757 numMergedOcc 0
11 mol 288 unq 1 iso 0 dist 9.11602 8.19596 5.58788 7.17626 13.3487 9.38112 8.82948 15.3271 11.1391 5.41757 numMergedOcc 0
12 mol 289 unq 0 iso 0 dist 9.11602 9.13071 11.7624 7.17626 13.3487 4.70335 8.82948 15.3271 7.26562 5.41757 numMergedOcc 0
13 mol 289 unq 1 iso 0 dist 9.11602 8.19596 5.58788 7.17626 13.3487 9.38112 8.82948 15.3271 11.1391 5.41757 numMergedOcc 0
