0 mol 43 unq 0 iso 0 dist 8.25984 4.22382 5.51659 9.79678 4.64937 8.84944 numMergedOcc 0
1 mol 43 unq 1 iso 0 dist 8.25984 4.22382 5.51659 11.2099 7.95541 7.21995 numMergedOcc 0
2 mol 64 unq 0 iso 0 dist 7.8986 12.4741 7.03264 16.1558 10.8544 5.66803 numMergedOcc 0
3 mol 64 unq 1 iso 0 dist 7.8986 12.4741 7.03264 17.9264 10.8964 8.85416 numMergedOcc 0
4 mol 64 unq 2 iso 0 dist 7.24183 8.05994 7.03264 11.7816 10.8544 5.66803 numMergedOcc 0
5 mol 64 unq 3 iso 0 dist 7.24183 8.05994 7.03264 15.2206 10.8964 8.85416 numMergedOcc 0
6 mol 127 unq 0 iso 0 dist 8.48435 5.61104 9.62885 10.5293 9.81852 5.83719 numMergedOcc 0
7 mol 133 unq 0 iso 0 dist 7.96689 8.17831 6.00667 7.74278 7.72261 5.79195 numMergedOcc 0
8 mol 133 unq 1 iso 0 dist 7.96689 8.17831 6.00667 16.0524 15.0617 9.2759 numMergedOcc 0
9 mol 133 unq 2 iso 0 dist 7.96689 8.17831 6.00667 8.08807 13.0543 8.76088 numMergedOcc 0
10 mol 133 unq 3 iso 0 dist 9.6582 11.5137 6.00667 8.54607 7.72261 5.79195 numMergedOcc 0
11 mol 133 unq 4 iso 0 dist 9.6582 11.5137 6.00667 19.5737 15.0617 9.2759 numMergedOcc 0
12 mol 133 unq 5 iso 0 dist 9.6582 11.5137 6.00667 11.9543 13.0543 8.76088 numMergedOcc 0
13 mol 133 unq 6 iso 0 dist 4.83134 8.17831 8.00919 7.74278 4.27464 5.79195 numMergedOcc 0
14 mol 133 unq 7 iso 0 dist 4.83134 8.17831 8.00919 16.0524 14.8239 9.2759 numMergedOcc 0
15 mol 133 unq 8 iso 0 dist 4.83134 8.17831 8.00919 8.08807 8.08082 8.76088 numMergedOcc 0
16 mol 133 unq 9 iso 0 dist 5.17734 11.5137 8.00919 8.54607 4.27464 5.79195 numMergedOcc 0
17 mol 133 unq 10 iso 0 dist 5.17734 11.5137 8.00919 19.5737 14.8239 9.2759 numMergedOcc 0
18 mol 133 unq 11 iso 0 dist 5.17734 11.5137 8.00919 11.9543 8.08082 8.76088 numMergedOcc 0
19 mol 139 unq 0 iso 0 dist 9.75151 9.61342 8.66615 17.4454 10.5769 9.70154 numMergedOcc 0
20 mol 139 unq 1 iso 0 dist 9.75151 9.61342 8.66615 13.6173 6.5333 8.78382 numMergedOcc 0
21 mol 152 unq 0 iso 0 dist 9.57285 4.57152 6.89622 10.149 5.05633 9.65031 numMergedOcc 0
22 mol 152 unq 1 iso 0 dist 9.57285 4.57152 6.89622 11.7308 6.97725 8.51844 numMergedOcc 0
23 mol 175 unq 0 iso 0 dist 6.03184 4.40729 5.25888 9.77407 4.44885 7.03107 numMergedOcc 0
24 mol 175 unq 1 iso 0 dist 6.03184 4.40729 5.25888 9.30469 4.81365 7.30813 numMergedOcc 0
25 mol 182 unq 0 iso 0 dist 8.94671 9.4786 8.63031 8.22267 4.39505 8.27913 numMergedOcc 0
26 mol 182 unq 1 iso 0 dist 8.94671 9.4786 8.63031 15.921 11.2827 8.85111 numMergedOcc 0
27 mol 182 unq 2 iso 0 dist 8.94671 9.4786 8.63031 12.1334 13.728 6.38335 numMergedOcc 0
28 mol 206 unq 0 iso 0 dist 7.65323 9.10202 8.75124 8.21649 4.85877 9.42047 numMergedOcc 0
29 mol 206 unq 1 iso 0 dist 8.63033 10.2573 9.24348 12.3482 10.9533 6.52136 numMergedOcc 0
30 mol 209 unq 0 iso 0 dist 8.12883 10.2809 8.21628 16.0837 9.75303 9.79293 numMergedOcc 0
31 mol 220 unq 0 iso 0 dist 7.86207 8.20682 7.81237 10.9225 6.555 5.25149 numMergedOcc 0
32 mol 239 unq 0 iso 0 dist 7.21466 6.18958 8.39251 14.8954 13.9599 8.86185 numMergedOcc 0
33 mol 266 unq 0 iso 0 dist 9.77392 9.64323 7.96955 15.2986 9.54337 6.57444 numMergedOcc 0
34 mol 266 unq 1 iso 0 dist 9.77392 9.64323 7.96955 15.2815 15.1918 9.39714 numMergedOcc 0
35 mol 266 unq 2 iso 0 dist 5.28417 4.15609 8.67354 10.835 14.5953 7.9555 numMergedOcc 0
36 mol 266 unq 3 iso 0 dist 5.28417 4.15609 8.67354 10.821 15.7187 8.8646 numMergedOcc 0
