0 mol 18 unq 0 iso 0 dist 8.24798 5.3982 6.72533 6.39307 4.95319 8.43157 numMergedOcc 0
1 mol 18 unq 1 iso 0 dist 8.02079 5.3982 8.29216 6.39307 6.19959 8.43157 numMergedOcc 0
2 mol 112 unq 0 iso 0 dist 9.28645 9.10324 9.37708 10.9517 8.58795 6.88696 numMergedOcc 0
3 mol 130 unq 0 iso 0 dist 4.69926 9.75051 8.26291 16.2662 12.9175 8.15289 numMergedOcc 0
4 mol 175 unq 0 iso 0 dist 8.43256 4.85698 8.39634 12.7793 8.81502 8.87876 numMergedOcc 0
5 mol 175 unq 1 iso 0 dist 8.14202 5.60933 8.39634 12.1547 8.81502 8.87876 numMergedOcc 0
6 mol 186 unq 0 iso 0 dist 8.52322 9.45075 8.40343 9.18289 9.00121 7.7734 numMergedOcc 0
7 mol 207 unq 0 iso 0 dist 7.98453 6.26853 4.55528 12.034 6.68112 6.06003 numMergedOcc 0
8 mol 218 unq 0 iso 0 dist 7.43427 6.86057 5.98076 10.3502 6.13691 8.38813 numMergedOcc 0
9 mol 218 unq 1 iso 0 dist 7.50841 12.1138 5.98076 10.863 6.13691 8.38813 numMergedOcc 0
10 mol 230 unq 0 iso 0 dist 8.95575 4.35944 5.00735 11.7524 5.01206 7.8356 numMergedOcc 0
11 mol 235 unq 0 iso 0 dist 8.52954 8.47815 7.52696 10.3757 7.4921 4.36956 numMergedOcc 0
12 mol 235 unq 1 iso 0 dist 8.52954 8.47815 7.52696 10.9793 4.7126 8.43799 numMergedOcc 0
13 mol 239 unq 0 iso 0 dist 9.87224 7.04644 4.21935 7.63381 8.15025 7.69491 numMergedOcc 0
14 mol 277 unq 0 iso 0 dist 7.91992 4.54209 9.42812 12.2259 17.13 8.18813 numMergedOcc 0
15 mol 279 unq 0 iso 0 dist 8.8643 6.17316 8.36655 10.632 5.03816 8.9352 numMergedOcc 0
16 mol 279 unq 1 iso 0 dist 9.24895 7.88157 8.76889 10.6808 7.51644 5.8845 numMergedOcc 0
17 mol 279 unq 2 iso 0 dist 8.34154 12.3885 8.76889 7.59142 7.51644 5.8845 numMergedOcc 0
18 mol 279 unq 3 iso 0 dist 9.07176 12.3885 7.04397 7.59142 3.75346 5.8845 numMergedOcc 0
19 mol 279 unq 4 iso 0 dist 5.90456 12.8668 8.36655 7.59142 5.03816 8.9352 numMergedOcc 0
20 mol 283 unq 0 iso 0 dist 9.69083 12.4856 6.15136 15.0534 5.83652 5.05882 numMergedOcc 0
21 mol 283 unq 1 iso 0 dist 5.96202 5.49773 6.15136 7.81241 5.83652 5.05882 numMergedOcc 0
22 mol 283 unq 2 iso 0 dist 9.55068 5.8402 6.15136 10.7881 5.83652 5.05882 numMergedOcc 0
