0 mol 20 unq 0 iso 0 dist 8.45518 5.88082 6.83357 9.08652 7.89835 10.3493 numMergedOcc 0
1 mol 20 unq 1 iso 0 dist 8.45518 5.88082 6.83357 12.575 9.94205 13.242 numMergedOcc 0
2 mol 20 unq 2 iso 0 dist 8.45518 5.88082 6.83357 13.5049 9.08453 14.4544 numMergedOcc 0
3 mol 20 unq 3 iso 0 dist 8.45518 5.35469 4.71011 9.08652 7.89835 6.29237 numMergedOcc 0
4 mol 20 unq 4 iso 0 dist 8.45518 5.35469 4.71011 12.575 9.94205 9.24286 numMergedOcc 0
5 mol 20 unq 5 iso 0 dist 8.45518 5.35469 4.71011 13.5049 9.08453 10.5059 numMergedOcc 0
6 mol 33 unq 0 iso 0 dist 5.65377 7.77567 5.63669 4.24935 8.66089 11.1778 numMergedOcc 0
7 mol 33 unq 1 iso 0 dist 5.65377 7.77567 5.63669 7.00849 6.9181 11.0057 numMergedOcc 0
8 mol 33 unq 2 iso 0 dist 5.65377 7.77567 5.63669 9.8286 5.84349 10.3837 numMergedOcc 0
9 mol 91 unq 0 iso 0 dist 9.19143 5.73003 6.21391 5.92311 6.64714 5.97918 numMergedOcc 0
10 mol 91 unq 1 iso 0 dist 9.23907 5.21227 6.21391 10.4112 6.64714 5.97918 numMergedOcc 0
11 mol 100 unq 0 iso 0 dist 9.90038 9.74416 9.05059 14.1132 8.29463 17.0319 numMergedOcc 0
12 mol 123 unq 0 iso 0 dist 9.61215 7.27898 12.2778 14.2421 6.49766 18.2888 numMergedOcc 0
13 mol 196 unq 0 iso 0 dist 7.21836 8.94535 9.74325 10.4797 4.48862 12.8268 numMergedOcc 0
14 mol 278 unq 0 iso 0 dist 6.25295 8.05084 9.44004 7.12222 9.90216 15.1655 numMergedOcc 0
15 mol 283 unq 0 iso 0 dist 9.24924 5.34771 8.40497 7.95433 8.106 8.47034 numMergedOcc 0
16 mol 283 unq 1 iso 0 dist 9.24924 9.2825 8.03948 7.95433 8.106 8.79936 numMergedOcc 0
17 mol 283 unq 2 iso 0 dist 9.72248 9.40332 8.40497 7.04425 8.106 8.47034 numMergedOcc 0
18 mol 283 unq 3 iso 0 dist 9.72248 5.8676 8.03948 7.04425 8.106 8.79936 numMergedOcc 0
19 mol 287 unq 0 iso 0 dist 7.80478 7.86603 6.80232 5.96447 9.98518 9.62446 numMergedOcc 0
20 mol 288 unq 0 iso 0 dist 7.80478 7.86603 6.80232 5.96447 9.98518 9.62446 numMergedOcc 0
21 mol 289 unq 0 iso 0 dist 7.80478 7.86603 6.80232 5.96447 9.98518 9.62446 numMergedOcc 0
