0 mol 10 unq 0 iso 0 dist 8.61887 5.94028 9.88507 8.91477 9.97671 10.9227 numMergedOcc 0
1 mol 17 unq 0 iso 0 dist 5.59897 5.01551 7.8304 8.02917 6.5643 8.8862 numMergedOcc 0
2 mol 17 unq 1 iso 0 dist 5.59897 8.27744 5.74567 8.02917 6.5643 4.3591 numMergedOcc 0
3 mol 17 unq 2 iso 0 dist 8.22412 6.75718 7.8304 4.6248 6.5643 8.8862 numMergedOcc 0
4 mol 17 unq 3 iso 0 dist 8.22412 6.92283 5.74567 4.6248 6.5643 4.3591 numMergedOcc 0
5 mol 26 unq 0 iso 0 dist 9.88379 4.85572 5.56687 5.74789 9.54171 5.54542 numMergedOcc 0
6 mol 46 unq 0 iso 0 dist 8.63312 6.75554 6.02472 10.3128 7.44805 3.57198 numMergedOcc 0
7 mol 48 unq 0 iso 0 dist 8.80801 16.0155 9.48288 14.2731 8.52681 5.39812 numMergedOcc 0
8 mol 48 unq 1 iso 0 dist 8.80801 16.0155 9.48288 14.6657 9.98769 3.59761 numMergedOcc 0
9 mol 48 unq 2 iso 0 dist 8.5859 15.9751 9.16212 14.5118 9.40291 3.60121 numMergedOcc 0
10 mol 48 unq 3 iso 0 dist 8.5859 15.9751 9.16212 14.0609 7.94814 5.37655 numMergedOcc 0
11 mol 48 unq 4 iso 0 dist 8.5859 15.9751 9.16212 14.4284 9.55632 8.48119 numMergedOcc 0
12 mol 171 unq 0 iso 0 dist 8.95953 10.537 9.00621 12.9261 8.65769 3.72812 numMergedOcc 0
13 mol 186 unq 0 iso 0 dist 6.94326 8.03698 8.53237 8.19192 8.35588 15.0132 numMergedOcc 0
14 mol 210 unq 0 iso 0 dist 8.14122 10.8427 9.1828 5.30972 6.58557 5.5553 numMergedOcc 0
15 mol 239 unq 0 iso 0 dist 8.39251 11.3614 8.87182 10.326 9.58325 5.88357 numMergedOcc 0
16 mol 239 unq 1 iso 0 dist 8.39251 11.3034 5.95622 10.326 9.58325 9.24057 numMergedOcc 0
17 mol 239 unq 2 iso 0 dist 8.99865 11.6736 8.87182 10.3996 9.58325 5.88357 numMergedOcc 0
18 mol 239 unq 3 iso 0 dist 8.99865 5.20078 5.95622 10.3996 9.58325 9.24057 numMergedOcc 0
19 mol 268 unq 0 iso 0 dist 8.56839 6.58374 6.68794 9.73914 9.06348 3.75857 numMergedOcc 0
