0 mol 19 unq 0 iso 0 dist 6.20943 8.40416 11.4087 7.83352 6.00439 15.4288 4.44441 6.38574 12.7679 4.23427 numMergedOcc 0
1 mol 19 unq 1 iso 0 dist 6.20943 8.40416 11.4087 7.67038 7.82528 7.75618 4.44441 6.38574 12.7679 10.0411 numMergedOcc 0
2 mol 19 unq 2 iso 0 dist 7.82528 7.75618 11.4087 10.8007 6.00439 15.4288 10.0411 6.38574 12.7679 4.23427 numMergedOcc 0
3 mol 19 unq 3 iso 0 dist 7.82528 7.75618 11.4087 7.67038 6.20943 8.40416 10.0411 6.38574 12.7679 4.44441 numMergedOcc 0
4 mol 19 unq 4 iso 0 dist 8.58657 6.41423 5.90856 7.07775 9.80108 10.741 12.323 7.40236 12.8274 10.3996 numMergedOcc 0
5 mol 26 unq 0 iso 0 dist 8.82012 6.46104 4.98603 13.2136 9.16962 10.177 12.8511 7.84204 11.7007 15.962 numMergedOcc 0
6 mol 45 unq 0 iso 0 dist 9.43442 9.53378 8.70414 5.48601 7.06308 10.862 6.16709 9.44125 9.09185 9.89212 numMergedOcc 0
7 mol 45 unq 1 iso 0 dist 9.43442 9.53378 8.70414 5.101 6.34173 10.6216 6.16709 9.44125 9.09185 5.84319 numMergedOcc 0
8 mol 58 unq 0 iso 0 dist 8.26899 7.21955 10.8421 7.08557 9.33535 13.2397 8.44881 8.88313 12.2293 4.63196 numMergedOcc 0
9 mol 58 unq 1 iso 0 dist 8.26899 7.21955 10.8421 7.08557 9.33535 13.2397 4.25144 5.48837 9.97953 4.57635 numMergedOcc 0
10 mol 184 unq 0 iso 0 dist 9.52936 6.42735 7.4793 5.43299 9.15417 10.3218 7.44296 9.46392 10.9454 5.48752 numMergedOcc 0
11 mol 194 unq 0 iso 0 dist 6.47873 8.65535 10.7231 8.48054 8.38695 13.9101 11.7478 9.76225 16.1826 3.77029 numMergedOcc 0
12 mol 213 unq 0 iso 0 dist 9.59129 7.37798 12.1116 13.7995 8.45368 16.5606 4.67313 7.77553 10.7796 9.90805 numMergedOcc 0
13 mol 213 unq 1 iso 0 dist 9.59129 7.73322 9.93085 13.7995 8.45368 16.3542 4.67313 7.77553 8.59946 9.90805 numMergedOcc 0
14 mol 218 unq 0 iso 0 dist 7.17547 6.1951 7.21048 7.83217 7.13323 10.8165 14.5747 8.5244 15.6098 11.7256 numMergedOcc 0
15 mol 232 unq 0 iso 0 dist 7.07392 8.50102 10.9886 4.96364 9.62952 12.3651 4.14873 8.49913 11.6437 6.71567 numMergedOcc 0
16 mol 234 unq 0 iso 0 dist 6.25105 9.81425 13.0631 5.88703 7.85175 13.293 13.8525 7.91374 19.3548 12.7879 numMergedOcc 0
17 mol 238 unq 0 iso 0 dist 9.90142 7.57812 10.3147 5.40359 5.9216 10.1217 8.71924 8.54425 14.4206 4.56594 numMergedOcc 0
18 mol 238 unq 1 iso 0 dist 9.90142 8.69104 15.6823 5.40359 5.9216 13.492 8.71924 8.54425 17.1864 4.56594 numMergedOcc 0
19 mol 238 unq 2 iso 0 dist 8.14172 7.02333 4.38002 5.31152 6.77463 8.67864 10.1977 8.71877 11.9026 5.7648 numMergedOcc 0
20 mol 238 unq 3 iso 0 dist 6.77463 8.67864 4.38002 5.31152 8.14172 7.02333 5.7648 8.71877 11.9026 10.1977 numMergedOcc 0
