0 mol 24 unq 0 iso 0 dist 6.6834 13.4994 7.95042 4.30555 7.7447 15.4638 10.9795 10.0453 9.41441 14.8722 numMergedOcc 0
1 mol 54 unq 0 iso 0 dist 6.94712 5.40129 7.16132 5.15508 9.41463 6.91496 10.6943 7.06251 7.07339 13.1774 numMergedOcc 0
2 mol 54 unq 1 iso 0 dist 6.94712 5.40129 7.16132 5.15508 9.41463 6.91496 9.46449 3.81228 7.23317 11.0484 numMergedOcc 0
3 mol 69 unq 0 iso 0 dist 7.21134 10.6174 6.9362 16.036 9.08745 10.8149 9.71247 5.1678 9.97775 10.9816 numMergedOcc 0
4 mol 69 unq 1 iso 0 dist 7.40698 5.6966 6.9362 11.2122 9.08745 10.8149 12.3217 5.1678 9.97775 10.9816 numMergedOcc 0
5 mol 95 unq 0 iso 0 dist 8.57607 4.16047 8.27883 6.56529 4.3439 4.73066 8.4204 15.7954 9.49454 13.7457 numMergedOcc 0
6 mol 95 unq 1 iso 0 dist 6.1991 4.16047 5.75428 6.56529 6.05855 4.73066 8.4204 10.4348 9.49454 13.7457 numMergedOcc 0
7 mol 113 unq 0 iso 0 dist 5.32773 12.9469 8.80934 3.71942 4.30875 13.0914 8.49444 7.1951 8.8822 9.34113 numMergedOcc 0
8 mol 113 unq 1 iso 0 dist 5.32773 12.9469 8.80934 3.71942 4.30875 13.0914 5.55446 3.84573 9.66219 5.35711 numMergedOcc 0
9 mol 113 unq 2 iso 0 dist 5.32773 12.9469 8.80934 9.01611 8.65807 12.5818 8.49444 7.1951 8.8822 14.2952 numMergedOcc 0
10 mol 113 unq 3 iso 0 dist 5.32773 12.9469 8.80934 9.01611 8.65807 12.5818 5.55446 3.84573 9.66219 11.8845 numMergedOcc 0
11 mol 184 unq 0 iso 0 dist 8.09403 4.59843 5.96423 9.24858 5.23187 5.03539 6.71675 4.67256 6.42735 7.02762 numMergedOcc 0
12 mol 186 unq 0 iso 0 dist 9.00537 9.40374 6.61112 16.5552 9.17458 12.2442 6.19189 4.03697 8.73217 12.0142 numMergedOcc 0
13 mol 186 unq 1 iso 0 dist 9.00537 9.40374 6.61112 14.3824 7.36794 11.7398 6.19189 4.03697 8.73217 9.5207 numMergedOcc 0
14 mol 186 unq 2 iso 0 dist 8.9388 12.4751 6.61112 9.09753 9.17458 12.2442 8.34668 4.03697 8.73217 12.0142 numMergedOcc 0
15 mol 186 unq 3 iso 0 dist 8.9388 12.4751 6.61112 6.7472 7.36794 11.7398 8.34668 4.03697 8.73217 9.5207 numMergedOcc 0
16 mol 205 unq 0 iso 0 dist 6.32553 9.40714 6.52816 3.30102 4.97301 6.49049 6.32542 5.28417 6.03688 5.59832 numMergedOcc 0
17 mol 213 unq 0 iso 0 dist 8.04327 7.18317 8.21793 4.88386 9.02881 4.67313 9.65238 8.75651 7.37798 10.7796 numMergedOcc 0
18 mol 213 unq 1 iso 0 dist 8.04327 7.18317 8.21793 4.88386 9.02881 4.67313 12.009 8.99471 7.73322 8.59946 numMergedOcc 0
19 mol 235 unq 0 iso 0 dist 6.92276 6.19292 6.29377 5.7279 8.60314 3.99115 7.90349 5.2878 8.69356 8.73715 numMergedOcc 0
20 mol 235 unq 1 iso 0 dist 8.75776 11.041 6.29377 11.2299 8.60314 3.99115 9.82675 5.2878 8.69356 8.73715 numMergedOcc 0
