0 mol 4 unq 0 iso 0 dist 6.12485 6.66589 6.56189 4.70233 10.361 9.71908 10.0491 12.0562 6.8787 9.84876 numMergedOcc 0
1 mol 4 unq 1 iso 0 dist 6.86951 9.80478 6.56189 7.10738 10.361 9.71908 11.4473 12.0562 6.8787 9.84876 numMergedOcc 0
2 mol 4 unq 2 iso 0 dist 9.04027 6.66589 6.22773 4.70233 12.4173 9.71908 10.0491 11.6227 6.8787 9.84876 numMergedOcc 0
3 mol 64 unq 0 iso 0 dist 8.85416 9.99634 6.43864 10.8964 7.03264 6.6003 17.9264 12.4741 9.48441 7.8986 numMergedOcc 0
4 mol 64 unq 1 iso 0 dist 8.85416 9.99634 6.43864 10.8964 7.03264 6.6003 15.2206 8.05994 6.41829 7.24183 numMergedOcc 0
5 mol 133 unq 0 iso 0 dist 8.8353 9.89098 16.1558 7.52391 11.8747 9.48243 7.4963 5.25819 11.9436 7.96689 numMergedOcc 0
6 mol 133 unq 1 iso 0 dist 8.8353 9.89098 16.1558 7.52391 11.8747 9.48243 10.8308 5.86018 16.3678 9.6582 numMergedOcc 0
7 mol 175 unq 0 iso 0 dist 7.03107 6.6776 4.51101 11.3267 9.56953 8.69888 9.77407 4.40729 5.73338 6.21546 numMergedOcc 0
8 mol 175 unq 1 iso 0 dist 7.03107 6.6776 4.51101 4.44885 5.25888 5.08206 9.77407 4.40729 5.73338 6.03184 numMergedOcc 0
9 mol 182 unq 0 iso 0 dist 8.27913 9.36307 8.27268 4.39505 8.63031 7.86625 8.22267 9.4786 4.85077 8.94671 numMergedOcc 0
10 mol 206 unq 0 iso 0 dist 9.42047 7.0119 4.1887 4.85877 8.75124 8.31638 8.21649 9.10202 7.20088 7.65323 numMergedOcc 0
11 mol 206 unq 1 iso 0 dist 9.42047 7.0119 4.1887 8.77652 13.7429 9.72979 14.466 15.9557 12.1408 8.63033 numMergedOcc 0
12 mol 214 unq 0 iso 0 dist 7.82201 9.40003 17.1162 10.6403 16.0716 8.49704 15.1445 15.9721 17.404 9.81136 numMergedOcc 0
13 mol 220 unq 0 iso 0 dist 6.39087 7.30244 12.2765 11.8854 12.8507 8.48112 6.45234 5.9596 8.70715 9.17355 numMergedOcc 0
14 mol 220 unq 1 iso 0 dist 6.39087 7.30244 12.2765 11.8854 12.8507 8.48112 12.428 14.6159 8.22716 8.5434 numMergedOcc 0
15 mol 220 unq 2 iso 0 dist 9.86144 9.58343 12.2765 12.1621 12.8507 8.48112 11.4496 5.9596 8.70715 9.17355 numMergedOcc 0
16 mol 220 unq 3 iso 0 dist 9.86144 9.58343 12.2765 12.1621 12.8507 8.48112 16.4521 14.6159 8.22716 8.5434 numMergedOcc 0
17 mol 220 unq 4 iso 0 dist 9.89039 8.9077 13.6952 15.8912 18.0183 7.31105 10.9225 12.9564 6.19375 7.57712 numMergedOcc 0
18 mol 220 unq 5 iso 0 dist 8.57174 8.9077 13.8822 15.8912 19.6341 7.31105 10.9225 13.2522 6.19375 7.57712 numMergedOcc 0
19 mol 223 unq 0 iso 0 dist 6.97426 7.34316 8.64175 6.5658 11.4192 7.82697 9.03969 12.4791 4.21803 7.57564 numMergedOcc 0
20 mol 223 unq 1 iso 0 dist 8.87456 7.34316 12.9895 6.5658 13.9012 7.82697 9.03969 16.4578 4.21803 7.57564 numMergedOcc 0
21 mol 258 unq 0 iso 0 dist 8.10903 9.67877 13.3533 9.0655 14.766 5.73296 13.4359 17.297 4.6881 8.97411 numMergedOcc 0
22 mol 258 unq 1 iso 0 dist 7.25618 9.67877 15.0574 9.0655 15.9916 5.73296 13.4359 18.4839 4.6881 8.97411 numMergedOcc 0
