0 mol 42 unq 0 iso 0 dist 7.06199 5.94284 5.37955 10.2834 8.52254 11.2985 numMergedOcc 0
1 mol 78 unq 0 iso 0 dist 7.80757 6.88471 5.40759 8.73 9.99029 7.85668 numMergedOcc 0
2 mol 78 unq 1 iso 0 dist 5.02591 7.74797 5.40759 8.07212 9.99029 7.85668 numMergedOcc 0
3 mol 91 unq 0 iso 0 dist 7.28711 5.21227 6.76794 7.54043 8.30169 9.86879 numMergedOcc 0
4 mol 91 unq 1 iso 0 dist 7.28711 5.21227 6.76794 8.05785 8.91983 7.3937 numMergedOcc 0
5 mol 108 unq 0 iso 0 dist 5.95326 5.25296 6.75224 6.46636 6.11003 10.3322 numMergedOcc 0
6 mol 108 unq 1 iso 0 dist 5.95326 6.55728 9.38238 6.46636 6.11003 11.1261 numMergedOcc 0
7 mol 132 unq 0 iso 0 dist 9.0339 9.7415 14.303 14.2364 6.2403 19.9082 numMergedOcc 0
8 mol 132 unq 1 iso 0 dist 9.0339 9.7415 14.303 8.84157 6.495 13.8846 numMergedOcc 0
9 mol 132 unq 2 iso 0 dist 8.48641 9.7415 11.7302 14.2364 8.34869 19.9082 numMergedOcc 0
10 mol 132 unq 3 iso 0 dist 8.48641 9.7415 11.7302 8.84157 9.43748 13.8846 numMergedOcc 0
11 mol 220 unq 0 iso 0 dist 7.96424 8.16081 14.1217 4.36623 7.30244 8.01243 numMergedOcc 0
12 mol 220 unq 1 iso 0 dist 7.96424 8.16081 14.1217 7.60777 9.58343 13.5871 numMergedOcc 0
13 mol 220 unq 2 iso 0 dist 5.40366 8.16081 9.83649 4.36623 7.29796 8.01243 numMergedOcc 0
14 mol 224 unq 0 iso 0 dist 7.69537 8.26636 4.32714 9.41461 7.04127 9.55911 numMergedOcc 0
15 mol 224 unq 1 iso 0 dist 7.69537 7.02669 8.95149 9.41461 7.04127 11.9468 numMergedOcc 0
16 mol 231 unq 0 iso 0 dist 9.84965 9.29492 9.72658 14.1831 9.98232 18.8899 numMergedOcc 0
17 mol 250 unq 0 iso 0 dist 6.18342 9.86436 4.43989 7.09073 8.21206 12.3475 numMergedOcc 0
18 mol 272 unq 0 iso 0 dist 7.22438 5.15197 6.38267 10.4121 4.78812 10.5176 numMergedOcc 0
19 mol 272 unq 1 iso 0 dist 7.66615 5.15197 5.99934 10.4121 6.62923 10.5176 numMergedOcc 0
