0 mol 20 unq 0 iso 0 dist 8.91975 9.63181 10.5266 11.7016 9.49938 16.7106 numMergedOcc 0
1 mol 83 unq 0 iso 0 dist 7.0847 6.07433 11.7659 12.0152 7.99541 17.1132 numMergedOcc 0
2 mol 100 unq 0 iso 0 dist 9.74416 6.6157 4.50298 8.28108 9.76814 6.34031 numMergedOcc 0
3 mol 100 unq 1 iso 0 dist 9.64454 7.37771 4.50298 6.48142 9.76814 6.34031 numMergedOcc 0
4 mol 120 unq 0 iso 0 dist 6.82156 8.41086 10.3855 7.69205 9.91108 15.8636 numMergedOcc 0
5 mol 120 unq 1 iso 0 dist 6.82156 8.41086 10.3855 5.97613 8.16411 13.9455 numMergedOcc 0
6 mol 123 unq 0 iso 0 dist 9.93167 9.47346 13.7302 10.3797 9.93886 19.0338 numMergedOcc 0
7 mol 123 unq 1 iso 0 dist 9.93167 9.47346 13.7302 4.43198 6.49558 10.8541 numMergedOcc 0
8 mol 123 unq 2 iso 0 dist 9.93167 9.47346 13.7302 10.713 9.35857 17.3387 numMergedOcc 0
9 mol 184 unq 0 iso 0 dist 7.79858 5.92785 9.96392 4.96558 6.4064 9.13228 numMergedOcc 0
10 mol 184 unq 1 iso 0 dist 7.19946 5.92785 5.65874 4.96558 7.17252 9.13228 numMergedOcc 0
11 mol 272 unq 0 iso 0 dist 9.97008 9.1926 14.8278 11.7088 9.04583 18.798 numMergedOcc 0
12 mol 272 unq 1 iso 0 dist 9.97008 9.17894 17.2633 11.7088 9.04583 20.1921 numMergedOcc 0
13 mol 278 unq 0 iso 0 dist 6.95272 8.71212 5.93697 4.39811 9.88046 11.6865 numMergedOcc 0
14 mol 278 unq 1 iso 0 dist 6.95272 8.60481 7.27472 4.39811 9.88046 8.91606 numMergedOcc 0
15 mol 287 unq 0 iso 0 dist 7.86603 5.62568 5.41757 8.62795 8.27165 10.0038 numMergedOcc 0
16 mol 287 unq 1 iso 0 dist 7.86603 5.62568 5.41757 11.5033 8.0077 11.8219 numMergedOcc 0
17 mol 287 unq 2 iso 0 dist 7.17626 8.82948 5.41757 10.1679 8.27165 10.0038 numMergedOcc 0
18 mol 287 unq 3 iso 0 dist 7.17626 8.82948 5.41757 14.6038 8.0077 11.8219 numMergedOcc 0
19 mol 288 unq 0 iso 0 dist 7.86603 5.62568 5.41757 8.62795 8.27165 10.0038 numMergedOcc 0
20 mol 288 unq 1 iso 0 dist 7.86603 5.62568 5.41757 11.5033 8.0077 11.8219 numMergedOcc 0
21 mol 288 unq 2 iso 0 dist 7.17626 8.82948 5.41757 10.1679 8.27165 10.0038 numMergedOcc 0
22 mol 288 unq 3 iso 0 dist 7.17626 8.82948 5.41757 14.6038 8.0077 11.8219 numMergedOcc 0
23 mol 289 unq 0 iso 0 dist 7.86603 5.62568 5.41757 8.62795 8.27165 10.0038 numMergedOcc 0
24 mol 289 unq 1 iso 0 dist 7.86603 5.62568 5.41757 11.5033 8.0077 11.8219 numMergedOcc 0
25 mol 289 unq 2 iso 0 dist 7.17626 8.82948 5.41757 10.1679 8.27165 10.0038 numMergedOcc 0
26 mol 289 unq 3 iso 0 dist 7.17626 8.82948 5.41757 14.6038 8.0077 11.8219 numMergedOcc 0
