0 mol 5 unq 0 iso 0 dist 8.70824 4.42081 8.97274 4.9568 10.7591 7.56229 3.67097 6.86923 3.14155 5.69239 numMergedOcc 0
1 mol 5 unq 1 iso 0 dist 5.93404 4.42081 7.5815 4.9568 3.91535 7.56229 3.67097 4.60775 3.14155 5.69239 numMergedOcc 0
2 mol 29 unq 0 iso 0 dist 9.99467 8.03211 9.78134 12.4197 13.1956 5.99655 15.5783 17.9644 8.80559 9.2087 numMergedOcc 0
3 mol 48 unq 0 iso 0 dist 9.04514 12.2639 8.8645 14.4979 6.44604 7.78689 20.6217 13.8065 9.26377 8.22812 numMergedOcc 0
4 mol 48 unq 1 iso 0 dist 9.04514 12.2639 8.8645 14.4979 6.44604 7.78689 14.436 8.52681 4.88527 4.22002 numMergedOcc 0
5 mol 48 unq 2 iso 0 dist 9.04514 12.2639 8.8645 14.4979 6.44604 7.78689 16.0856 10.084 4.76279 5.77855 numMergedOcc 0
6 mol 48 unq 3 iso 0 dist 9.04514 12.2639 8.8645 14.4979 6.44604 7.78689 12.7654 9.98769 5.56357 8.10774 numMergedOcc 0
7 mol 48 unq 4 iso 0 dist 9.04514 12.2639 8.8645 14.4979 6.44604 7.78689 16.4822 10.9073 9.94951 6.5241 numMergedOcc 0
8 mol 48 unq 5 iso 0 dist 9.14072 12.5909 8.3491 14.9479 6.4561 7.70645 12.884 9.40291 5.43784 8.14245 numMergedOcc 0
9 mol 48 unq 6 iso 0 dist 9.14072 12.5909 8.3491 14.9479 6.4561 7.70645 16.8922 10.6705 9.7018 6.36817 numMergedOcc 0
10 mol 48 unq 7 iso 0 dist 9.14072 12.5909 8.3491 14.9479 6.4561 7.70645 20.7539 13.4464 8.95384 8.0812 numMergedOcc 0
11 mol 48 unq 8 iso 0 dist 9.14072 12.5909 8.3491 14.9479 6.4561 7.70645 14.5015 7.94814 4.57947 4.17933 numMergedOcc 0
12 mol 48 unq 9 iso 0 dist 9.14072 12.5909 8.3491 14.9479 6.4561 7.70645 16.2483 9.55632 4.60843 5.54893 numMergedOcc 0
13 mol 79 unq 0 iso 0 dist 5.55798 6.35003 6.30814 8.97789 9.13196 4.74254 12.8316 13.3239 7.19532 6.20144 numMergedOcc 0
14 mol 83 unq 0 iso 0 dist 6.77845 6.51558 5.25361 9.94528 4.48523 5.35861 5.31562 5.13041 3.62753 7.50925 numMergedOcc 0
15 mol 83 unq 1 iso 0 dist 6.77845 6.51558 5.25361 9.94528 4.48523 5.35861 9.24212 8.57603 3.65203 6.96722 numMergedOcc 0
16 mol 83 unq 2 iso 0 dist 6.77845 6.51558 5.25361 13.5083 9.79852 8.61641 9.24212 8.57603 3.65203 7.61085 numMergedOcc 0
17 mol 83 unq 3 iso 0 dist 5.48555 9.07479 5.25361 8.94777 4.48523 5.35861 8.56578 5.13041 3.62753 7.50925 numMergedOcc 0
18 mol 83 unq 4 iso 0 dist 5.48555 9.07479 5.25361 8.94777 4.48523 5.35861 12.1198 8.57603 3.65203 6.96722 numMergedOcc 0
19 mol 83 unq 5 iso 0 dist 5.48555 9.07479 5.25361 12.8722 9.79852 8.61641 12.1198 8.57603 3.65203 7.61085 numMergedOcc 0
20 mol 83 unq 6 iso 0 dist 5.39805 7.0157 5.25361 9.28583 4.48523 5.35861 3.7497 5.13041 3.62753 7.50925 numMergedOcc 0
21 mol 83 unq 7 iso 0 dist 5.39805 7.0157 5.25361 9.28583 4.48523 5.35861 10.5451 8.57603 3.65203 6.96722 numMergedOcc 0
22 mol 83 unq 8 iso 0 dist 5.39805 7.0157 5.25361 14.4893 9.79852 8.61641 10.5451 8.57603 3.65203 7.61085 numMergedOcc 0
23 mol 168 unq 0 iso 0 dist 5.60956 9.43003 8.18217 6.48066 3.60864 7.0961 3.56227 5.64732 6.06538 5.86767 numMergedOcc 0
24 mol 168 unq 1 iso 0 dist 5.60956 9.43003 8.18217 6.48066 3.60864 7.0961 3.96437 5.52214 10.919 5.28353 numMergedOcc 0
25 mol 168 unq 2 iso 0 dist 5.60956 8.01699 5.51167 6.48066 3.60864 8.21227 3.56227 5.64732 9.99868 5.86767 numMergedOcc 0
26 mol 168 unq 3 iso 0 dist 5.60956 8.01699 5.51167 6.48066 3.60864 8.21227 3.96437 5.52214 6.91388 5.28353 numMergedOcc 0
27 mol 169 unq 0 iso 0 dist 6.09291 6.22697 7.06772 7.50458 10.1931 7.65903 4.24401 6.27378 3.18152 5.10589 numMergedOcc 0
28 mol 169 unq 1 iso 0 dist 6.09291 6.22697 7.06772 5.79554 10.5136 5.97653 4.24401 6.27378 3.18152 4.63336 numMergedOcc 0
29 mol 169 unq 2 iso 0 dist 6.09291 6.22697 7.06772 4.22003 10.212 7.75523 4.24401 6.27378 3.18152 6.10715 numMergedOcc 0
30 mol 169 unq 3 iso 0 dist 9.76796 6.51773 7.06772 13.1014 10.1931 7.65903 9.223 6.27378 3.18152 5.10589 numMergedOcc 0
31 mol 169 unq 4 iso 0 dist 9.76796 6.51773 7.06772 12.3054 10.5136 5.97653 9.223 6.27378 3.18152 4.63336 numMergedOcc 0
32 mol 169 unq 5 iso 0 dist 9.76796 6.51773 7.06772 14.1761 10.212 7.75523 9.223 6.27378 3.18152 6.10715 numMergedOcc 0
33 mol 169 unq 6 iso 0 dist 9.90583 7.82714 7.06772 11.8729 10.1931 7.65903 9.35916 6.27378 3.18152 5.10589 numMergedOcc 0
34 mol 169 unq 7 iso 0 dist 9.90583 7.82714 7.06772 12.9435 10.5136 5.97653 9.35916 6.27378 3.18152 4.63336 numMergedOcc 0
35 mol 169 unq 8 iso 0 dist 9.90583 7.82714 7.06772 15.2645 10.212 7.75523 9.35916 6.27378 3.18152 6.10715 numMergedOcc 0
36 mol 287 unq 0 iso 0 dist 6.96248 11.9352 8.43856 15.6343 9.67218 6.22311 13.6065 9.67507 5.96434 6.24487 numMergedOcc 0
37 mol 288 unq 0 iso 0 dist 6.96248 11.9352 8.43856 15.6343 9.67218 6.22311 13.6065 9.67507 5.96434 6.24487 numMergedOcc 0
38 mol 289 unq 0 iso 0 dist 6.96248 11.9352 8.43856 15.6343 9.67218 6.22311 13.6065 9.67507 5.96434 6.24487 numMergedOcc 0
