0 mol 0 unq 0 iso 0 dist 9.42137 4.59249 7.37981 11.6896 9.6994 12.7599 12.1052 5.25456 8.24206 13.5517 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 9.42137 4.59249 7.37981 14.5258 7.15528 13.3337 12.1052 5.25456 8.24206 9.5614 numMergedOcc 0
2 mol 0 unq 2 iso 0 dist 9.42137 12.6412 7.19621 11.6896 9.6994 9.95 12.1052 5.25456 6.19218 13.5517 numMergedOcc 0
3 mol 0 unq 3 iso 0 dist 9.42137 12.6412 7.19621 11.6896 9.6994 9.95 16.2851 7.1599 7.19397 12.3538 numMergedOcc 0
4 mol 0 unq 4 iso 0 dist 9.42137 12.6412 7.19621 14.5258 7.15528 6.83587 12.1052 5.25456 6.19218 9.5614 numMergedOcc 0
5 mol 0 unq 5 iso 0 dist 9.42137 12.6412 7.19621 14.5258 7.15528 6.83587 16.2851 7.1599 7.19397 5.55156 numMergedOcc 0
6 mol 14 unq 0 iso 0 dist 8.13983 5.2767 8.73627 5.63648 6.38364 9.18933 11.3232 9.55728 7.04966 12.4371 numMergedOcc 0
7 mol 14 unq 1 iso 0 dist 6.45858 8.1206 8.73627 4.05028 6.38364 9.18933 12.9293 9.55728 7.04966 12.4371 numMergedOcc 0
8 mol 14 unq 2 iso 0 dist 6.87018 10.5329 8.39221 5.45641 6.38364 7.00835 10.6822 4.15151 7.66311 8.91266 numMergedOcc 0
9 mol 16 unq 0 iso 0 dist 9.76968 5.98953 5.84479 4.2139 6.31718 5.35079 13.1436 5.66097 7.88676 10.8592 numMergedOcc 0
10 mol 16 unq 1 iso 0 dist 9.76968 5.98953 5.84479 12.1754 7.63133 6.53177 13.1436 5.66097 7.88676 7.46752 numMergedOcc 0
11 mol 38 unq 0 iso 0 dist 5.73067 5.47531 9.23576 5.79134 7.50293 7.35595 7.96306 7.46414 5.86972 8.80956 numMergedOcc 0
12 mol 38 unq 1 iso 0 dist 5.73067 5.47531 9.23576 5.48241 9.91611 8.59794 7.96306 7.46414 5.86972 12.4417 numMergedOcc 0
13 mol 119 unq 0 iso 0 dist 6.18763 4.46648 6.49205 5.3154 6.18601 5.19198 9.82219 4.99061 8.24549 6.85677 numMergedOcc 0
14 mol 129 unq 0 iso 0 dist 9.28278 4.99299 6.29026 14.5776 8.54584 11.5533 7.13958 4.80675 7.07421 10.1938 numMergedOcc 0
15 mol 214 unq 0 iso 0 dist 9.51764 15.3761 8.49704 6.28065 9.65138 12.4611 23.5093 17.404 9.81136 18.7061 numMergedOcc 0
16 mol 214 unq 1 iso 0 dist 9.51764 15.3761 8.49704 11.2159 7.14453 11.832 23.5093 17.404 9.81136 17.5046 numMergedOcc 0
17 mol 214 unq 2 iso 0 dist 9.51764 15.3761 8.49704 6.53326 8.85478 10.644 23.5093 17.404 9.81136 18.1374 numMergedOcc 0
18 mol 214 unq 3 iso 0 dist 5.36829 8.72971 8.49704 11.7583 9.65138 12.4611 15.1372 17.404 9.81136 18.7061 numMergedOcc 0
19 mol 214 unq 4 iso 0 dist 5.36829 8.72971 8.49704 4.98764 7.14453 11.832 15.1372 17.404 9.81136 17.5046 numMergedOcc 0
20 mol 214 unq 5 iso 0 dist 5.36829 8.72971 8.49704 12.3481 8.85478 10.644 15.1372 17.404 9.81136 18.1374 numMergedOcc 0
21 mol 224 unq 0 iso 0 dist 8.39002 9.97999 9.33771 9.98893 8.95269 5.41021 14.5968 11.4653 7.62593 4.79841 numMergedOcc 0
22 mol 224 unq 1 iso 0 dist 8.39002 9.97999 9.33771 5.72088 6.57273 4.91322 14.5968 11.4653 7.62593 9.04374 numMergedOcc 0
23 mol 224 unq 2 iso 0 dist 8.39002 9.97999 9.33771 6.51315 5.78342 12.979 14.5968 11.4653 7.62593 15.1903 numMergedOcc 0
24 mol 224 unq 3 iso 0 dist 8.46129 9.97999 7.39839 6.31508 6.65832 7.65225 14.5968 12.5358 7.62593 14.7665 numMergedOcc 0
25 mol 224 unq 4 iso 0 dist 8.46129 9.97999 7.39839 5.72088 6.60589 4.91322 14.5968 12.5358 7.62593 9.04374 numMergedOcc 0
26 mol 224 unq 5 iso 0 dist 8.46129 9.97999 7.39839 6.51315 9.16166 12.979 14.5968 12.5358 7.62593 15.1903 numMergedOcc 0
27 mol 231 unq 0 iso 0 dist 8.01942 7.25343 6.14348 8.55683 8.40182 5.3251 14.4754 10.2117 7.28719 9.98232 numMergedOcc 0
28 mol 231 unq 1 iso 0 dist 8.01942 7.25343 6.14348 8.55683 8.40182 5.3251 12.7836 6.95128 6.60684 10.174 numMergedOcc 0
29 mol 238 unq 0 iso 0 dist 9.13537 4.34203 6.83152 10.3859 6.57393 10.8336 9.29888 9.76195 5.57184 15.3066 numMergedOcc 0
30 mol 241 unq 0 iso 0 dist 9.10633 11.4382 9.72526 7.20238 7.4631 4.86437 10.9229 7.93809 9.174 6.40592 numMergedOcc 0
31 mol 249 unq 0 iso 0 dist 6.37672 11.3437 7.29898 9.07501 7.57994 6.6173 17.0768 12.5843 6.18866 12.4678 numMergedOcc 0
32 mol 249 unq 1 iso 0 dist 6.37672 11.3437 7.29898 4.24014 6.18582 8.95486 17.0768 12.5843 6.18866 15.0782 numMergedOcc 0
33 mol 249 unq 2 iso 0 dist 6.37672 13.0712 8.91685 9.07501 7.57994 5.25611 17.0768 12.5843 9.3807 12.4678 numMergedOcc 0
34 mol 249 unq 3 iso 0 dist 6.37672 13.0712 8.91685 4.24014 6.18582 9.66184 17.0768 12.5843 9.3807 15.0782 numMergedOcc 0
35 mol 249 unq 4 iso 0 dist 8.94023 11.2158 7.29898 9.53929 7.57994 6.6173 16.4949 12.5843 6.18866 12.4678 numMergedOcc 0
36 mol 249 unq 5 iso 0 dist 8.94023 11.2158 7.29898 5.36989 6.18582 8.95486 16.4949 12.5843 6.18866 15.0782 numMergedOcc 0
37 mol 249 unq 6 iso 0 dist 8.94023 13.8209 8.91685 9.53929 7.57994 5.25611 16.4949 12.5843 9.3807 12.4678 numMergedOcc 0
38 mol 249 unq 7 iso 0 dist 8.94023 13.8209 8.91685 5.36989 6.18582 9.66184 16.4949 12.5843 9.3807 15.0782 numMergedOcc 0
39 mol 258 unq 0 iso 0 dist 5.73834 3.95075 8.58088 6.48867 6.60405 10.221 9.52903 9.78068 7.70189 14.0712 numMergedOcc 0
40 mol 258 unq 1 iso 0 dist 5.73834 3.95075 8.58088 7.52881 6.42289 9.22664 9.52903 9.78068 7.70189 8.81059 numMergedOcc 0
41 mol 259 unq 0 iso 0 dist 5.90645 6.13878 6.77279 4.62072 8.53687 7.55268 13.3227 13.6207 8.73077 15.7201 numMergedOcc 0
42 mol 259 unq 1 iso 0 dist 5.90645 6.13878 6.77279 4.62072 8.53687 7.55268 12.4319 10.908 6.76656 14.2826 numMergedOcc 0
43 mol 259 unq 2 iso 0 dist 5.90645 6.13878 6.77279 10.4985 8.13497 5.71237 13.3227 13.6207 8.73077 11.4871 numMergedOcc 0
44 mol 259 unq 3 iso 0 dist 5.90645 6.13878 6.77279 10.4985 8.13497 5.71237 12.4319 10.908 6.76656 6.96379 numMergedOcc 0
45 mol 259 unq 4 iso 0 dist 9.54857 5.09929 7.93997 15.3806 7.46176 14.8465 13.9163 8.63445 9.45077 14.4933 numMergedOcc 0
46 mol 259 unq 5 iso 0 dist 9.54857 5.09929 7.93997 15.3806 7.46176 14.8465 8.06908 6.18571 4.55368 13.6279 numMergedOcc 0
47 mol 277 unq 0 iso 0 dist 9.29635 15.5244 6.90434 10.8075 9.7748 13.2927 16.5458 7.44724 6.23539 14.2462 numMergedOcc 0
