0 mol 7 unq 0 iso 0 dist 9.20552 15.1647 8.41585 5.26458 5.99972 12.0193 12.839 5.13353 11.659 9.68006 numMergedOcc 0
1 mol 16 unq 0 iso 0 dist 6.68517 5.65481 4.7319 5.1333 6.72833 6.51133 11.9541 10.4852 11.6856 6.93532 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 7.40392 8.23069 5.54419 8.92687 8.4051 5.11617 15.0861 15.5315 11.0194 7.29868 numMergedOcc 0
3 mol 24 unq 1 iso 0 dist 7.40392 8.23069 5.54419 8.92687 8.4051 5.11617 11.6497 14.6259 13.2433 8.60554 numMergedOcc 0
4 mol 24 unq 2 iso 0 dist 7.40392 8.23069 5.54419 5.12527 8.75662 10.8238 11.6497 14.6259 13.2433 9.44691 numMergedOcc 0
5 mol 24 unq 3 iso 0 dist 7.40392 8.59466 7.36323 8.92687 8.4051 13.2229 15.0861 15.5315 20.3888 7.29868 numMergedOcc 0
6 mol 24 unq 4 iso 0 dist 7.40392 8.59466 7.36323 8.92687 8.4051 13.2229 11.6497 14.6259 15.5296 8.60554 numMergedOcc 0
7 mol 24 unq 5 iso 0 dist 7.40392 8.59466 7.36323 5.12527 8.75662 6.7828 11.6497 14.6259 15.5296 9.44691 numMergedOcc 0
8 mol 25 unq 0 iso 0 dist 8.94828 14.2406 7.57578 6.84017 6.16347 9.34396 13.2682 10.9391 12.7009 7.45383 numMergedOcc 0
9 mol 25 unq 1 iso 0 dist 8.94828 14.2406 7.57578 15.5398 7.92503 6.11127 15.0254 10.6808 13.7311 8.6653 numMergedOcc 0
10 mol 25 unq 2 iso 0 dist 8.94828 15.6642 7.17969 6.84017 6.16347 10.8498 13.2682 10.9391 12.8117 7.45383 numMergedOcc 0
11 mol 25 unq 3 iso 0 dist 8.94828 15.6642 7.17969 15.5398 7.92503 5.30154 15.0254 10.6808 12.9968 8.6653 numMergedOcc 0
12 mol 58 unq 0 iso 0 dist 9.81637 11.9429 6.62496 6.18332 5.93884 5.78774 14.9123 5.30792 6.86465 9.92355 numMergedOcc 0
13 mol 58 unq 1 iso 0 dist 9.81637 11.9429 6.62496 6.18332 5.93884 5.78774 12.4928 4.81926 6.35756 7.68678 numMergedOcc 0
14 mol 100 unq 0 iso 0 dist 9.61812 11.5079 8.87449 7.76066 7.80975 7.97897 14.7281 10.8586 10.9461 7.10378 numMergedOcc 0
15 mol 115 unq 0 iso 0 dist 9.50575 6.68557 5.11551 13.4067 6.92026 6.77806 12.88 6.5838 7.11972 5.88249 numMergedOcc 0
16 mol 115 unq 1 iso 0 dist 9.50575 6.68557 5.11551 13.4067 6.92026 6.77806 18.2151 10.5564 11.8863 6.97707 numMergedOcc 0
17 mol 115 unq 2 iso 0 dist 8.43116 4.96719 5.11551 5.19545 6.92026 6.77806 6.23645 6.5838 7.11972 5.88249 numMergedOcc 0
18 mol 115 unq 3 iso 0 dist 8.43116 4.96719 5.11551 5.19545 6.92026 6.77806 9.62812 10.5564 11.8863 6.97707 numMergedOcc 0
19 mol 115 unq 4 iso 0 dist 6.23645 4.96719 7.11972 5.19545 5.88249 6.77806 8.43116 6.5838 5.11551 6.92026 numMergedOcc 0
20 mol 115 unq 5 iso 0 dist 6.23645 4.96719 7.11972 5.19545 5.88249 6.77806 9.62812 5.67807 11.8863 6.97707 numMergedOcc 0
21 mol 115 unq 6 iso 0 dist 6.23645 6.47836 6.90986 5.19545 5.88249 5.31484 8.43116 6.5838 11.4095 6.92026 numMergedOcc 0
22 mol 115 unq 7 iso 0 dist 6.23645 6.47836 6.90986 5.19545 5.88249 5.31484 9.62812 5.67807 5.39945 6.97707 numMergedOcc 0
23 mol 133 unq 0 iso 0 dist 9.94179 6.75154 6.5107 4.77149 6.66772 7.12976 13.2418 6.69554 9.66421 9.97654 numMergedOcc 0
24 mol 133 unq 1 iso 0 dist 9.94179 6.75154 6.5107 4.77149 6.66772 7.12976 12.2738 7.6656 12.0352 7.71248 numMergedOcc 0
25 mol 133 unq 2 iso 0 dist 9.94179 6.70853 9.52634 4.77149 6.66772 4.34568 13.2418 6.69554 9.91388 9.97654 numMergedOcc 0
26 mol 133 unq 3 iso 0 dist 9.94179 6.70853 9.52634 4.77149 6.66772 4.34568 12.2738 7.6656 7.24514 7.71248 numMergedOcc 0
27 mol 134 unq 0 iso 0 dist 4.68975 9.30817 9.89303 6.64576 5.83771 7.41674 4.9155 5.79898 6.54501 7.80532 numMergedOcc 0
28 mol 134 unq 1 iso 0 dist 4.9155 9.30817 6.54501 6.64576 7.80532 7.41674 4.68975 5.79898 9.89303 5.83771 numMergedOcc 0
29 mol 134 unq 2 iso 0 dist 4.9155 10.879 6.49416 6.64576 7.80532 9.87376 4.68975 5.79898 9.93925 5.83771 numMergedOcc 0
30 mol 134 unq 3 iso 0 dist 8.49987 6.47843 6.54501 5.54455 7.80532 7.41674 9.64152 5.79898 9.89303 5.83771 numMergedOcc 0
31 mol 134 unq 4 iso 0 dist 8.49987 10.9399 6.49416 5.54455 7.80532 9.87376 9.64152 5.79898 9.93925 5.83771 numMergedOcc 0
32 mol 134 unq 5 iso 0 dist 9.42271 6.16353 6.54501 5.87436 7.80532 7.41674 9.15658 5.79898 9.89303 5.83771 numMergedOcc 0
33 mol 134 unq 6 iso 0 dist 9.42271 7.07625 6.49416 5.87436 7.80532 9.87376 9.15658 5.79898 9.93925 5.83771 numMergedOcc 0
34 mol 134 unq 7 iso 0 dist 5.79157 13.0109 9.86662 12.2847 9.94764 4.57832 12.6199 11.3271 11.9139 7.69991 numMergedOcc 0
35 mol 134 unq 8 iso 0 dist 5.79157 13.0109 9.86662 12.2847 9.94764 4.57832 9.87619 6.81259 8.94367 6.23142 numMergedOcc 0
36 mol 134 unq 9 iso 0 dist 5.79157 14.1608 9.71307 12.2847 9.94764 5.29786 12.6199 11.3271 9.5126 7.69991 numMergedOcc 0
37 mol 134 unq 10 iso 0 dist 5.79157 14.1608 9.71307 12.2847 9.94764 5.29786 9.87619 6.81259 6.37586 6.23142 numMergedOcc 0
38 mol 186 unq 0 iso 0 dist 8.77347 6.05728 7.54065 10.0244 8.73217 11.7429 16.3574 14.5862 16.3985 7.76163 numMergedOcc 0
39 mol 235 unq 0 iso 0 dist 7.8128 5.49043 5.4638 12.5723 9.55668 7.60081 15.0268 9.89669 11.3258 6.95126 numMergedOcc 0
40 mol 278 unq 0 iso 0 dist 9.91518 12.8387 8.44326 11.8916 8.00673 4.97614 14.371 8.29447 10.6095 6.62841 numMergedOcc 0
