0 mol 12 unq 0 iso 0 dist 6.13335 9.32718 5.38708 4.46781 9.41745 13.4327 numMergedOcc 0
1 mol 43 unq 0 iso 0 dist 7.81257 7.84444 6.2885 5.84171 9.16827 11.6477 numMergedOcc 0
2 mol 70 unq 0 iso 0 dist 9.28709 8.06918 10.7301 9.17087 7.95122 8.33704 numMergedOcc 0
3 mol 70 unq 1 iso 0 dist 9.28709 8.06918 10.7301 5.33532 9.74268 7.92394 numMergedOcc 0
4 mol 70 unq 2 iso 0 dist 9.28709 7.52623 11.7565 9.17087 7.95122 11.6205 numMergedOcc 0
5 mol 70 unq 3 iso 0 dist 9.28709 7.52623 11.7565 5.33532 9.74268 9.93423 numMergedOcc 0
6 mol 70 unq 4 iso 0 dist 9.28709 5.62294 12.3296 9.17087 7.95122 13.4942 numMergedOcc 0
7 mol 70 unq 5 iso 0 dist 9.28709 5.62294 12.3296 5.33532 9.74268 9.34122 numMergedOcc 0
8 mol 122 unq 0 iso 0 dist 6.12598 9.55337 11.1873 5.24418 7.43775 14.741 numMergedOcc 0
9 mol 122 unq 1 iso 0 dist 6.12598 9.55337 11.1873 9.66073 8.09594 18.1438 numMergedOcc 0
10 mol 160 unq 0 iso 0 dist 9.5 9.9938 6.78759 11.1642 9.20228 15.1952 numMergedOcc 0
11 mol 167 unq 0 iso 0 dist 5.7126 9.4422 7.76836 12.6052 9.73922 10.5089 numMergedOcc 0
12 mol 214 unq 0 iso 0 dist 8.61758 8.20906 12.6724 4.7088 8.3035 12.3623 numMergedOcc 0
13 mol 214 unq 1 iso 0 dist 5.45548 8.20906 5.23668 4.7088 9.01896 12.3623 numMergedOcc 0
14 mol 248 unq 0 iso 0 dist 8.2748 7.96942 12.3766 6.86606 8.34646 14.4409 numMergedOcc 0
15 mol 253 unq 0 iso 0 dist 5.85222 7.64415 7.05014 12.3321 7.0247 13.2206 numMergedOcc 0
16 mol 253 unq 1 iso 0 dist 5.85222 7.83041 3.494 12.3321 7.0247 7.19465 numMergedOcc 0
17 mol 287 unq 0 iso 0 dist 6.2587 8.70062 9.81184 9.05051 9.22576 9.85934 numMergedOcc 0
18 mol 287 unq 1 iso 0 dist 6.2587 9.919 12.6962 9.05051 9.22576 18.783 numMergedOcc 0
19 mol 288 unq 0 iso 0 dist 6.2587 8.70062 9.81184 9.05051 9.22576 9.85934 numMergedOcc 0
20 mol 288 unq 1 iso 0 dist 6.2587 9.919 12.6962 9.05051 9.22576 18.783 numMergedOcc 0
21 mol 289 unq 0 iso 0 dist 6.2587 8.70062 9.81184 9.05051 9.22576 9.85934 numMergedOcc 0
22 mol 289 unq 1 iso 0 dist 6.2587 9.919 12.6962 9.05051 9.22576 18.783 numMergedOcc 0
