0 mol 15 unq 0 iso 0 dist 9.29358 5.89412 6.19131 8.4014 11.1793 5.69755 6.91314 9.51568 6.23015 10.3229 numMergedOcc 0
1 mol 32 unq 0 iso 0 dist 8.68559 7.99969 7.14527 8.91596 4.84198 10.8132 10.7345 7.11053 11.636 8.78511 numMergedOcc 0
2 mol 58 unq 0 iso 0 dist 8.26899 7.21955 10.8421 9.4278 13.4402 4.97525 6.20618 7.60018 12.6602 13.8891 numMergedOcc 0
3 mol 58 unq 1 iso 0 dist 8.26899 7.21955 10.8421 9.4278 13.4402 4.97525 5.61579 7.03126 10.4354 10.8756 numMergedOcc 0
4 mol 72 unq 0 iso 0 dist 6.77912 9.27838 4.67641 4.86198 10.4337 13.6186 10.0679 9.37102 11.7561 13.1776 numMergedOcc 0
5 mol 72 unq 1 iso 0 dist 6.77912 9.27838 4.67641 4.86198 10.4337 13.6186 5.69391 5.4605 7.58875 9.92478 numMergedOcc 0
6 mol 72 unq 2 iso 0 dist 6.77912 9.27838 4.67641 4.86198 10.4337 13.6186 4.03844 6.53824 6.91169 8.77831 numMergedOcc 0
7 mol 130 unq 0 iso 0 dist 6.79146 7.88805 6.08911 9.81269 9.6361 3.88766 4.66904 8.9677 11.6521 13.3448 numMergedOcc 0
8 mol 184 unq 0 iso 0 dist 9.52936 6.42735 7.4793 9.84566 4.11581 5.05856 13.8904 7.59939 14.4075 11.4796 numMergedOcc 0
9 mol 184 unq 1 iso 0 dist 9.52936 6.42735 7.4793 8.22001 12.4034 5.69882 13.8904 7.59939 14.4075 19.3206 numMergedOcc 0
10 mol 213 unq 0 iso 0 dist 6.0965 7.37798 6.17282 8.82761 14.229 15.5804 10.1881 8.65196 14.4091 14.5549 numMergedOcc 0
11 mol 213 unq 1 iso 0 dist 6.0965 7.73322 10.5013 8.82761 14.229 6.78109 10.1881 8.65196 11.7032 14.5549 numMergedOcc 0
12 mol 213 unq 2 iso 0 dist 9.59129 7.37798 12.1116 8.82761 14.9475 15.5804 10.1881 5.461 14.4091 14.5549 numMergedOcc 0
13 mol 213 unq 3 iso 0 dist 9.59129 7.73322 9.93085 8.82761 14.9475 6.78109 10.1881 5.461 11.7032 14.5549 numMergedOcc 0
14 mol 218 unq 0 iso 0 dist 7.17547 6.1951 7.21048 6.1896 10.7049 5.34495 15.6802 8.61306 14.4908 18.2643 numMergedOcc 0
15 mol 218 unq 1 iso 0 dist 7.17547 6.1951 7.21048 6.09255 4.36581 3.83106 15.6802 8.61306 14.4908 11.3734 numMergedOcc 0
16 mol 235 unq 0 iso 0 dist 9.58736 9.55668 13.128 8.08965 14.2299 6.82702 13.7306 7.02029 13.3153 17.3764 numMergedOcc 0
17 mol 238 unq 0 iso 0 dist 6.05141 8.94014 11.5793 8.94231 3.94343 13.4894 5.27215 8.69525 12.1725 9.71857 numMergedOcc 0
18 mol 238 unq 1 iso 0 dist 8.09066 7.02333 11.5793 8.88652 3.94343 13.4894 6.13368 8.69525 12.1725 9.71857 numMergedOcc 0
19 mol 238 unq 2 iso 0 dist 7.2766 8.67864 11.5793 6.46771 3.94343 13.4894 10.0605 8.69525 12.1725 9.71857 numMergedOcc 0
