0 mol 18 unq 0 iso 0 dist 7.14173 8.46905 3.54066 9.91539 5.16057 8.31999 numMergedOcc 0
1 mol 18 unq 1 iso 0 dist 5.16057 5.03451 4.10012 9.91539 7.14173 10.7394 numMergedOcc 0
2 mol 36 unq 0 iso 0 dist 7.38433 5.58536 7.34881 5.71189 8.88147 10.7133 numMergedOcc 0
3 mol 36 unq 1 iso 0 dist 8.88147 6.6055 13.8997 5.71189 7.38433 10.1135 numMergedOcc 0
4 mol 91 unq 0 iso 0 dist 5.73003 8.66819 4.52107 7.06119 5.21227 8.47126 numMergedOcc 0
5 mol 91 unq 1 iso 0 dist 5.21227 8.47126 4.52107 7.06119 5.73003 8.66819 numMergedOcc 0
6 mol 123 unq 0 iso 0 dist 9.43033 9.85144 9.94939 5.33782 9.93167 6.60464 numMergedOcc 0
7 mol 123 unq 1 iso 0 dist 8.57379 8.09329 6.33721 3.65652 6.82663 6.13025 numMergedOcc 0
8 mol 123 unq 2 iso 0 dist 8.57379 5.80266 5.79985 3.65652 6.82663 6.78431 numMergedOcc 0
9 mol 123 unq 3 iso 0 dist 6.82663 5.18305 5.2546 3.65652 8.57379 8.39986 numMergedOcc 0
10 mol 123 unq 4 iso 0 dist 6.82663 6.13025 6.33721 3.65652 8.57379 8.09329 numMergedOcc 0
11 mol 123 unq 5 iso 0 dist 6.82663 6.78431 5.79985 3.65652 8.57379 5.80266 numMergedOcc 0
12 mol 123 unq 6 iso 0 dist 9.93167 6.60464 9.94939 5.33782 9.43033 9.85144 numMergedOcc 0
13 mol 184 unq 0 iso 0 dist 8.58798 5.84589 3.07409 13.5869 7.79858 10.1361 numMergedOcc 0
14 mol 184 unq 1 iso 0 dist 7.79858 6.03505 9.86813 13.5869 8.58798 15.1577 numMergedOcc 0
15 mol 184 unq 2 iso 0 dist 7.79858 6.30144 6.87402 13.5869 8.58798 15.2693 numMergedOcc 0
16 mol 272 unq 0 iso 0 dist 5.98984 8.54895 9.59378 4.18061 8.98905 12.2844 numMergedOcc 0
17 mol 272 unq 1 iso 0 dist 4.90884 8.54895 11.8573 4.18061 6.31909 12.2844 numMergedOcc 0
18 mol 283 unq 0 iso 0 dist 9.40332 8.3831 12.6476 4.80485 5.34771 10.5501 numMergedOcc 0
19 mol 283 unq 1 iso 0 dist 9.40332 8.44179 12.5852 4.80485 5.34771 9.6029 numMergedOcc 0
20 mol 283 unq 2 iso 0 dist 5.8676 8.3831 3.31521 4.80485 9.2825 10.5501 numMergedOcc 0
21 mol 283 unq 3 iso 0 dist 5.8676 8.44179 5.84931 4.80485 9.2825 9.6029 numMergedOcc 0
22 mol 287 unq 0 iso 0 dist 7.86603 6.23874 3.39991 12.8716 7.17626 10.5202 numMergedOcc 0
23 mol 287 unq 1 iso 0 dist 7.86603 6.68956 5.46505 12.8716 7.17626 10.7429 numMergedOcc 0
24 mol 288 unq 0 iso 0 dist 7.86603 6.23874 3.39991 12.8716 7.17626 10.5202 numMergedOcc 0
25 mol 288 unq 1 iso 0 dist 7.86603 6.68956 5.46505 12.8716 7.17626 10.7429 numMergedOcc 0
26 mol 289 unq 0 iso 0 dist 7.86603 6.23874 3.39991 12.8716 7.17626 10.5202 numMergedOcc 0
27 mol 289 unq 1 iso 0 dist 7.86603 6.68956 5.46505 12.8716 7.17626 10.7429 numMergedOcc 0
