0 mol 73 unq 0 iso 0 dist 8.93939 6.04163 4.60412 6.34076 9.41049 5.93252 numMergedOcc 0
1 mol 95 unq 0 iso 0 dist 9.11115 8.27456 12.0894 9.7565 9.64673 7.27724 numMergedOcc 0
2 mol 115 unq 0 iso 0 dist 8.73544 5.11612 6.37222 10.3475 15.5203 9.33865 numMergedOcc 0
3 mol 115 unq 1 iso 0 dist 8.73544 5.11612 6.37222 6.86762 11.5796 5.83991 numMergedOcc 0
4 mol 115 unq 2 iso 0 dist 8.93793 5.22628 6.51536 10.0419 15.6106 9.33865 numMergedOcc 0
5 mol 115 unq 3 iso 0 dist 8.93793 5.22628 6.51536 6.8104 11.9336 6.11741 numMergedOcc 0
6 mol 133 unq 0 iso 0 dist 8.61918 6.53153 6.55423 5.78974 13.8341 9.91388 numMergedOcc 0
7 mol 133 unq 1 iso 0 dist 8.61918 6.29975 10.2681 4.90674 9.64659 6.5107 numMergedOcc 0
8 mol 133 unq 2 iso 0 dist 8.61918 6.29975 10.2681 5.78974 13.8341 9.52634 numMergedOcc 0
9 mol 133 unq 3 iso 0 dist 8.61918 8.29673 13.1011 5.78974 13.8341 7.24514 numMergedOcc 0
10 mol 133 unq 4 iso 0 dist 8.61918 8.29673 13.1011 9.35671 14.011 8.22656 numMergedOcc 0
11 mol 152 unq 0 iso 0 dist 9.07154 9.37459 14.5814 8.41711 13.0805 5.87555 numMergedOcc 0
12 mol 152 unq 1 iso 0 dist 9.07154 9.37459 14.5814 4.82496 11.9198 8.87437 numMergedOcc 0
13 mol 152 unq 2 iso 0 dist 9.07154 9.0847 16.8649 14.8573 20.6147 8.56324 numMergedOcc 0
14 mol 152 unq 3 iso 0 dist 9.07154 9.0847 16.8649 8.41711 13.0805 6.70283 numMergedOcc 0
15 mol 152 unq 4 iso 0 dist 9.07154 9.0847 16.8649 4.82496 11.9198 7.16148 numMergedOcc 0
16 mol 152 unq 5 iso 0 dist 9.07154 6.00061 12.692 8.41711 13.0805 8.67331 numMergedOcc 0
17 mol 152 unq 6 iso 0 dist 9.07154 6.00061 12.692 4.82496 11.9198 8.05741 numMergedOcc 0
18 mol 181 unq 0 iso 0 dist 7.90753 8.80581 5.32364 10.209 11.9989 7.63312 numMergedOcc 0
19 mol 210 unq 0 iso 0 dist 5.89811 7.86668 5.4508 5.06314 6.13878 6.18308 numMergedOcc 0
20 mol 234 unq 0 iso 0 dist 5.68265 7.17032 4.93623 5.44278 5.46736 6.56247 numMergedOcc 0
21 mol 234 unq 1 iso 0 dist 5.68265 7.17032 4.93623 9.25445 10.8568 9.45496 numMergedOcc 0
22 mol 236 unq 0 iso 0 dist 7.61854 5.99137 7.45579 13.7629 11.8908 9.81562 numMergedOcc 0
23 mol 236 unq 1 iso 0 dist 7.61854 5.99137 7.45579 13.3575 12.0498 7.68742 numMergedOcc 0
24 mol 236 unq 2 iso 0 dist 7.61854 5.99137 7.45579 5.03598 5.90804 6.27581 numMergedOcc 0
25 mol 241 unq 0 iso 0 dist 5.42605 8.18588 7.3737 10.2076 12.8359 7.4631 numMergedOcc 0
26 mol 243 unq 0 iso 0 dist 8.82741 8.69557 14.0902 9.51148 17.7959 8.23192 numMergedOcc 0
27 mol 258 unq 0 iso 0 dist 7.87577 5.31858 5.90131 6.60345 9.04358 6.42289 numMergedOcc 0
28 mol 258 unq 1 iso 0 dist 5.86702 5.31858 4.51422 6.60345 10.0455 6.42289 numMergedOcc 0
29 mol 261 unq 0 iso 0 dist 5.74302 6.85589 5.09097 5.85483 9.77784 7.73141 numMergedOcc 0
30 mol 261 unq 1 iso 0 dist 5.74302 6.85589 5.09097 4.31412 5.00128 8.43057 numMergedOcc 0
31 mol 261 unq 2 iso 0 dist 5.74302 6.68878 4.86901 4.31412 5.00128 6.05727 numMergedOcc 0
32 mol 279 unq 0 iso 0 dist 9.87771 7.63115 8.00087 5.82892 14.3766 9.70696 numMergedOcc 0
33 mol 279 unq 1 iso 0 dist 9.10723 7.63115 9.98703 5.82892 14.3267 9.70696 numMergedOcc 0
