0 mol 0 unq 0 iso 0 dist 6.8892 5.55156 5.85361 7.1599 11.788 7.15528 12.3538 11.9892 7.19817 9.6994 numMergedOcc 0
1 mol 19 unq 0 iso 0 dist 8.75001 7.84393 12.48 9.01721 17.1733 7.82074 14.9301 20.934 10.3915 8.4674 numMergedOcc 0
2 mol 19 unq 1 iso 0 dist 8.75001 7.84393 12.48 9.01721 17.1733 7.82074 10.1953 16.91 5.03957 4.54938 numMergedOcc 0
3 mol 24 unq 0 iso 0 dist 7.69637 6.85331 9.1927 9.20254 12.0295 6.86014 10.4452 6.85527 10.0952 8.86116 numMergedOcc 0
4 mol 24 unq 1 iso 0 dist 9.22152 5.87895 6.7228 5.75653 13.3202 7.36323 11.0381 18.4364 12.3067 5.54419 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 8.90896 5.79954 4.78435 12.8388 11.6724 9.96396 10.4766 6.33833 5.4148 6.19304 numMergedOcc 0
6 mol 73 unq 1 iso 0 dist 8.90896 5.79954 4.78435 12.8388 11.6724 9.96396 15.4777 18.4819 14.9342 8.70481 numMergedOcc 0
7 mol 115 unq 0 iso 0 dist 9.41083 7.83568 11.8582 11.3906 18.1828 7.11972 17.2205 22.1555 10.498 6.90986 numMergedOcc 0
8 mol 127 unq 0 iso 0 dist 5.83719 6.65963 4.98711 10.345 11.2815 8.14887 8.62711 11.2447 7.30196 9.30299 numMergedOcc 0
9 mol 127 unq 1 iso 0 dist 5.83719 8.62711 11.2447 10.345 11.2815 9.30299 6.65963 4.98711 7.30196 8.14887 numMergedOcc 0
10 mol 133 unq 0 iso 0 dist 8.8353 9.89098 16.1558 8.96845 17.7988 9.91388 13.5771 21.0134 6.69554 9.52634 numMergedOcc 0
11 mol 133 unq 1 iso 0 dist 8.8353 9.89098 16.1558 8.96845 17.7988 9.91388 12.2343 20.1463 6.761 7.24514 numMergedOcc 0
12 mol 175 unq 0 iso 0 dist 7.03107 6.6776 4.51101 13.7028 13.3338 9.0018 11.1815 11.1501 7.42466 7.652 numMergedOcc 0
13 mol 175 unq 1 iso 0 dist 7.03107 6.6776 4.51101 10.4662 8.84385 5.6234 11.1815 11.1501 7.42466 9.92231 numMergedOcc 0
14 mol 181 unq 0 iso 0 dist 8.92801 9.63295 9.40823 12.5935 12.8027 7.63312 13.3844 8.12623 8.85576 7.81386 numMergedOcc 0
15 mol 181 unq 1 iso 0 dist 9.40718 9.63295 5.32364 12.5935 11.9989 7.63312 13.3844 13.9725 8.85576 7.81386 numMergedOcc 0
16 mol 236 unq 0 iso 0 dist 4.71683 6.73134 7.41812 5.27568 9.13551 8.35971 12.96 15.6279 14.2337 8.03456 numMergedOcc 0
17 mol 236 unq 1 iso 0 dist 4.71683 6.73134 7.41812 5.27568 9.13551 8.35971 10.8312 13.7246 14.7998 6.84306 numMergedOcc 0
18 mol 236 unq 2 iso 0 dist 4.71683 6.73134 7.41812 5.27568 9.13551 8.35971 11.2195 10.5269 10.7497 9.99038 numMergedOcc 0
19 mol 236 unq 3 iso 0 dist 4.71683 6.73134 7.41812 5.27568 9.13551 8.35971 14.0541 16.5976 12.0369 9.78037 numMergedOcc 0
20 mol 236 unq 4 iso 0 dist 8.63249 9.97357 13.6195 8.3919 11.8908 8.03456 6.36941 7.45579 7.28249 9.81562 numMergedOcc 0
21 mol 236 unq 5 iso 0 dist 8.63249 9.97357 13.6195 4.88785 12.0498 6.84306 6.36941 7.45579 7.28249 7.68742 numMergedOcc 0
22 mol 236 unq 6 iso 0 dist 8.63249 9.97357 13.6195 10.2557 5.90804 9.99038 6.36941 7.45579 7.28249 6.27581 numMergedOcc 0
23 mol 236 unq 7 iso 0 dist 8.63249 9.97357 13.6195 16.5918 16.1665 8.35971 16.6071 19.8999 7.43758 8.04248 numMergedOcc 0
24 mol 236 unq 8 iso 0 dist 8.63249 6.36941 7.45579 8.3919 11.8908 9.81562 9.97357 13.6195 7.28249 8.03456 numMergedOcc 0
25 mol 236 unq 9 iso 0 dist 8.63249 6.36941 7.45579 4.88785 12.0498 7.68742 9.97357 13.6195 7.28249 6.84306 numMergedOcc 0
26 mol 236 unq 10 iso 0 dist 8.63249 6.36941 7.45579 10.2557 5.90804 6.27581 9.97357 13.6195 7.28249 9.99038 numMergedOcc 0
27 mol 258 unq 0 iso 0 dist 8.10903 8.81059 5.90131 9.78068 9.04358 6.42289 14.0712 8.81588 7.26417 6.60405 numMergedOcc 0
28 mol 258 unq 1 iso 0 dist 8.70193 7.9357 4.51422 8.73372 10.0455 6.42289 13.7159 11.1234 7.26417 6.60405 numMergedOcc 0
29 mol 258 unq 2 iso 0 dist 7.25618 8.81059 4.51422 9.78068 10.0455 6.42289 14.0712 11.1234 7.26417 6.60405 numMergedOcc 0
30 mol 261 unq 0 iso 0 dist 8.88741 7.15785 6.43209 6.5875 7.30472 8.02547 13.1629 11.6843 10.0727 8.43057 numMergedOcc 0
31 mol 261 unq 1 iso 0 dist 8.88741 7.15785 6.43209 6.5875 7.30472 8.02547 9.43169 7.78464 5.51688 6.05727 numMergedOcc 0
32 mol 261 unq 2 iso 0 dist 8.88741 9.43169 7.78464 6.5875 7.30472 6.05727 7.15785 6.43209 5.51688 8.02547 numMergedOcc 0
33 mol 261 unq 3 iso 0 dist 8.88741 9.43169 7.78464 6.5875 7.30472 6.05727 13.1629 11.6843 4.63549 8.43057 numMergedOcc 0
34 mol 261 unq 4 iso 0 dist 7.58385 8.50313 6.88989 13.3163 13.5435 8.45658 11.3146 6.79406 7.00201 9.14619 numMergedOcc 0
35 mol 261 unq 5 iso 0 dist 6.0437 8.50313 4.25662 13.3163 12.1908 8.45658 11.3146 9.25465 7.00201 9.14619 numMergedOcc 0
36 mol 261 unq 6 iso 0 dist 4.85199 7.6414 4.25662 13.6041 12.1908 8.45658 13.063 9.25465 7.00201 9.14619 numMergedOcc 0
37 mol 261 unq 7 iso 0 dist 9.72159 7.6414 12.864 13.6041 20.1172 8.45658 13.063 19.1495 7.00201 9.14619 numMergedOcc 0
38 mol 280 unq 0 iso 0 dist 9.76967 9.26066 18.1328 12.5899 21.2961 6.53701 12.5331 19.9363 5.51836 6.0664 numMergedOcc 0
