0 mol 5 unq 0 iso 0 dist 6.84403 12.3662 9.45559 9.34574 4.84696 7.4332 14.1269 10.9683 8.33646 6.14476 numMergedOcc 0
1 mol 9 unq 0 iso 0 dist 9.3359 6.44447 4.75533 12.1084 5.47 5.85081 18.1716 10.9235 11.8626 6.11048 numMergedOcc 0
2 mol 9 unq 1 iso 0 dist 9.3359 6.44447 4.75533 12.1084 5.47 5.85081 18.4015 12.0338 13.1565 8.14998 numMergedOcc 0
3 mol 11 unq 0 iso 0 dist 9.76233 7.08799 9.74528 10.1536 14.8738 9.08736 6.64342 6.84216 7.86896 8.68293 numMergedOcc 0
4 mol 85 unq 0 iso 0 dist 7.61514 5.55433 7.51319 8.21116 2.58673 8.49887 12.3909 7.69926 10.7979 5.85237 numMergedOcc 0
5 mol 85 unq 1 iso 0 dist 7.61514 5.55433 7.51319 8.21116 2.58673 8.49887 17.1393 9.7173 15.9875 9.11768 numMergedOcc 0
6 mol 85 unq 2 iso 0 dist 8.21116 5.55433 8.49887 7.61514 2.58673 7.51319 12.3909 5.85237 10.7979 7.69926 numMergedOcc 0
7 mol 152 unq 0 iso 0 dist 9.3776 6.27142 9.07315 12.0109 6.01609 8.09561 12.8882 7.59457 10.0459 6.79114 numMergedOcc 0
8 mol 186 unq 0 iso 0 dist 7.82717 8.15466 6.97766 8.19926 6.13455 4.79423 11.8143 12.038 8.24478 5.90765 numMergedOcc 0
9 mol 194 unq 0 iso 0 dist 9.3032 11.9253 7.56217 12.7181 3.78714 9.81055 20.6518 13.001 18.4888 9.38984 numMergedOcc 0
10 mol 194 unq 1 iso 0 dist 9.3032 11.9253 7.56217 12.7181 3.78714 9.81055 20.3941 13.1712 19.6126 9.91118 numMergedOcc 0
11 mol 194 unq 2 iso 0 dist 8.10451 9.14049 7.56217 6.6747 3.78714 9.81055 11.1132 13.001 18.4888 9.38984 numMergedOcc 0
12 mol 194 unq 3 iso 0 dist 8.10451 9.14049 7.56217 6.6747 3.78714 9.81055 14.0553 13.1712 19.6126 9.91118 numMergedOcc 0
13 mol 194 unq 4 iso 0 dist 6.6747 9.14049 9.81055 8.10451 3.78714 7.56217 13.5654 11.7672 13.445 9.52922 numMergedOcc 0
14 mol 194 unq 5 iso 0 dist 6.28412 15.4443 9.81055 9.07241 3.78714 7.56217 16.0085 11.7672 13.445 9.52922 numMergedOcc 0
15 mol 253 unq 0 iso 0 dist 8.34984 6.3252 6.3093 14.4735 6.8233 9.80396 11.9048 9.1927 6.27022 8.94786 numMergedOcc 0
16 mol 266 unq 0 iso 0 dist 7.36685 13.3047 7.36137 9.03099 3.00605 4.95415 18.0944 12.0003 5.98169 9.29666 numMergedOcc 0
17 mol 266 unq 1 iso 0 dist 7.36685 5.66268 6.83784 9.03099 3.00605 6.38519 18.0944 12.0003 13.8919 9.29666 numMergedOcc 0
18 mol 285 unq 0 iso 0 dist 8.88717 5.29647 6.07843 10.1917 7.33055 9.66678 5.23192 6.71946 5.93692 5.03601 numMergedOcc 0
19 mol 285 unq 1 iso 0 dist 9.84651 6.56958 6.07843 13.5431 7.33055 9.66678 9.00041 6.71946 5.93692 5.03601 numMergedOcc 0
