0 mol 28 unq 0 iso 0 dist 6.87842 8.94643 11.4558 8.10455 9.2146 12.2603 15.1706 16.4255 14.6896 8.53424 numMergedOcc 0
1 mol 28 unq 1 iso 0 dist 6.87842 8.94643 11.4558 8.10455 9.2146 12.2603 14.1709 16.0765 15.7353 7.08766 numMergedOcc 0
2 mol 28 unq 2 iso 0 dist 6.87842 8.94643 11.4558 8.10455 9.2146 12.2603 12.7139 13.6412 15.2702 4.82199 numMergedOcc 0
3 mol 30 unq 0 iso 0 dist 7.13565 9.11745 3.08756 3.90342 8.67216 9.63882 4.62145 3.30447 6.09772 6.87277 numMergedOcc 0
4 mol 30 unq 1 iso 0 dist 7.13565 4.62145 3.30447 3.90342 8.67216 6.87277 9.11745 3.08756 6.09772 9.63882 numMergedOcc 0
5 mol 30 unq 2 iso 0 dist 7.13565 9.71995 10.8938 3.90342 8.67216 11.3258 9.11745 3.08756 11.1844 9.63882 numMergedOcc 0
6 mol 30 unq 3 iso 0 dist 7.13565 9.71995 10.8938 3.90342 8.67216 11.3258 4.62145 3.30447 11.2187 6.87277 numMergedOcc 0
7 mol 48 unq 0 iso 0 dist 8.8645 8.52681 4.88527 6.44604 7.78689 4.22002 13.8065 9.26377 6.87266 8.22812 numMergedOcc 0
8 mol 48 unq 1 iso 0 dist 8.8645 8.52681 4.88527 6.44604 7.78689 4.22002 10.084 4.76279 3.23184 5.77855 numMergedOcc 0
9 mol 48 unq 2 iso 0 dist 8.8645 8.52681 4.88527 6.44604 7.78689 4.22002 9.98769 5.56357 4.78728 8.10774 numMergedOcc 0
10 mol 48 unq 3 iso 0 dist 8.8645 8.52681 4.88527 6.44604 7.78689 4.22002 10.9073 9.94951 5.61785 6.5241 numMergedOcc 0
11 mol 48 unq 4 iso 0 dist 8.8645 9.98769 5.56357 6.44604 7.78689 8.10774 13.8065 9.26377 10.9047 8.22812 numMergedOcc 0
12 mol 48 unq 5 iso 0 dist 8.8645 9.98769 5.56357 6.44604 7.78689 8.10774 8.52681 4.88527 4.78728 4.22002 numMergedOcc 0
13 mol 48 unq 6 iso 0 dist 8.8645 9.98769 5.56357 6.44604 7.78689 8.10774 10.084 4.76279 7.18912 5.77855 numMergedOcc 0
14 mol 48 unq 7 iso 0 dist 8.8645 9.98769 5.56357 6.44604 7.78689 8.10774 10.9073 9.94951 6.20957 6.5241 numMergedOcc 0
15 mol 48 unq 8 iso 0 dist 8.3491 9.40291 5.43784 6.4561 7.70645 8.14245 10.6705 9.7018 6.29252 6.36817 numMergedOcc 0
16 mol 48 unq 9 iso 0 dist 8.3491 9.40291 5.43784 6.4561 7.70645 8.14245 13.4464 8.95384 10.8994 8.0812 numMergedOcc 0
17 mol 48 unq 10 iso 0 dist 8.3491 9.40291 5.43784 6.4561 7.70645 8.14245 7.94814 4.57947 4.73799 4.17933 numMergedOcc 0
18 mol 48 unq 11 iso 0 dist 8.3491 9.40291 5.43784 6.4561 7.70645 8.14245 9.55632 4.60843 7.19576 5.54893 numMergedOcc 0
19 mol 48 unq 12 iso 0 dist 8.3491 7.94814 4.57947 6.4561 7.70645 4.17933 9.40291 5.43784 4.73799 8.14245 numMergedOcc 0
20 mol 48 unq 13 iso 0 dist 8.3491 7.94814 4.57947 6.4561 7.70645 4.17933 10.6705 9.7018 5.553 6.36817 numMergedOcc 0
21 mol 48 unq 14 iso 0 dist 8.3491 7.94814 4.57947 6.4561 7.70645 4.17933 13.4464 8.95384 6.96103 8.0812 numMergedOcc 0
22 mol 48 unq 15 iso 0 dist 8.3491 7.94814 4.57947 6.4561 7.70645 4.17933 9.55632 4.60843 3.18526 5.54893 numMergedOcc 0
23 mol 48 unq 16 iso 0 dist 8.3491 9.55632 4.60843 6.4561 7.70645 5.54893 9.40291 5.43784 7.19576 8.14245 numMergedOcc 0
24 mol 48 unq 17 iso 0 dist 8.3491 9.55632 4.60843 6.4561 7.70645 5.54893 10.6705 9.7018 8.14415 6.36817 numMergedOcc 0
25 mol 48 unq 18 iso 0 dist 8.3491 9.55632 4.60843 6.4561 7.70645 5.54893 13.4464 8.95384 4.54874 8.0812 numMergedOcc 0
26 mol 48 unq 19 iso 0 dist 8.3491 9.55632 4.60843 6.4561 7.70645 5.54893 7.94814 4.57947 3.18526 4.17933 numMergedOcc 0
27 mol 83 unq 0 iso 0 dist 5.25361 5.13041 3.62753 4.48523 5.35861 7.50925 8.57603 3.65203 6.91034 6.96722 numMergedOcc 0
28 mol 83 unq 1 iso 0 dist 5.25361 5.13041 3.62753 9.79852 8.61641 11.9491 8.57603 3.65203 6.91034 7.61085 numMergedOcc 0
29 mol 147 unq 0 iso 0 dist 8.0732 6.42361 5.19008 3.7035 7.7464 3.82583 7.4121 5.27556 3.00464 5.19116 numMergedOcc 0
30 mol 147 unq 1 iso 0 dist 8.0732 7.4121 5.27556 3.7035 7.7464 5.19116 6.42361 5.19008 3.00464 3.82583 numMergedOcc 0
31 mol 147 unq 2 iso 0 dist 5.93918 6.42361 3.7729 3.7035 5.12272 3.82583 7.4121 6.34165 3.00464 5.19116 numMergedOcc 0
32 mol 147 unq 3 iso 0 dist 5.93918 6.42361 3.7729 3.20279 8.7121 8.25768 7.4121 6.34165 3.00464 8.71702 numMergedOcc 0
33 mol 147 unq 4 iso 0 dist 5.93918 7.4121 6.34165 3.7035 5.12272 5.19116 6.42361 3.7729 3.00464 3.82583 numMergedOcc 0
34 mol 147 unq 5 iso 0 dist 5.93918 7.4121 6.34165 3.20279 8.7121 8.71702 6.42361 3.7729 3.00464 8.25768 numMergedOcc 0
35 mol 168 unq 0 iso 0 dist 8.18217 5.64732 6.06538 3.60864 7.0961 5.86767 5.52214 10.919 6.37254 5.28353 numMergedOcc 0
36 mol 168 unq 1 iso 0 dist 8.18217 5.52214 10.919 3.60864 7.0961 5.28353 5.64732 6.06538 6.37254 5.86767 numMergedOcc 0
37 mol 168 unq 2 iso 0 dist 8.18217 5.80055 13.0096 3.60864 7.0961 8.89343 5.64732 6.06538 8.38976 5.86767 numMergedOcc 0
38 mol 168 unq 3 iso 0 dist 8.18217 5.80055 13.0096 3.60864 7.0961 8.89343 5.52214 10.919 6.81049 5.28353 numMergedOcc 0
39 mol 168 unq 4 iso 0 dist 8.18217 7.44481 14.104 3.60864 7.0961 9.52186 5.64732 6.06538 8.62142 5.86767 numMergedOcc 0
40 mol 168 unq 5 iso 0 dist 8.18217 7.44481 14.104 3.60864 7.0961 9.52186 5.52214 10.919 5.50898 5.28353 numMergedOcc 0
41 mol 168 unq 6 iso 0 dist 5.51167 5.64732 9.99868 3.60864 8.21227 5.86767 5.52214 6.91388 6.37254 5.28353 numMergedOcc 0
42 mol 168 unq 7 iso 0 dist 5.51167 5.52214 6.91388 3.60864 8.21227 5.28353 5.64732 9.99868 6.37254 5.86767 numMergedOcc 0
43 mol 168 unq 8 iso 0 dist 5.51167 5.80055 3.5168 3.60864 8.21227 8.89343 5.64732 9.99868 8.38976 5.86767 numMergedOcc 0
44 mol 168 unq 9 iso 0 dist 5.51167 5.80055 3.5168 3.60864 8.21227 8.89343 5.52214 6.91388 6.81049 5.28353 numMergedOcc 0
45 mol 168 unq 10 iso 0 dist 5.51167 7.44481 5.43054 3.60864 8.21227 9.52186 5.64732 9.99868 8.62142 5.86767 numMergedOcc 0
46 mol 168 unq 11 iso 0 dist 5.51167 7.44481 5.43054 3.60864 8.21227 9.52186 5.52214 6.91388 5.50898 5.28353 numMergedOcc 0
47 mol 266 unq 0 iso 0 dist 8.9221 6.39822 3.14784 10.1418 7.72861 7.8598 5.36518 5.95721 3.00605 7.80711 numMergedOcc 0
48 mol 266 unq 1 iso 0 dist 8.9221 6.39822 3.14784 7.63149 8.20376 8.25286 10.3444 3.68488 5.76129 6.96692 numMergedOcc 0
49 mol 266 unq 2 iso 0 dist 8.9221 6.39822 3.14784 7.63149 8.20376 8.25286 5.36518 5.95721 3.00605 9.9965 numMergedOcc 0
50 mol 266 unq 3 iso 0 dist 8.9221 5.36518 5.95721 10.1418 7.72861 7.80711 6.39822 3.14784 3.00605 7.8598 numMergedOcc 0
51 mol 266 unq 4 iso 0 dist 8.9221 5.36518 5.95721 7.63149 8.20376 9.9965 10.3444 3.68488 8.75066 6.96692 numMergedOcc 0
52 mol 266 unq 5 iso 0 dist 8.9221 5.36518 5.95721 7.63149 8.20376 9.9965 6.39822 3.14784 3.00605 8.25286 numMergedOcc 0
53 mol 266 unq 6 iso 0 dist 9.51145 9.90506 3.68488 10.3155 7.72861 10.9313 8.61077 3.14784 5.76129 7.8598 numMergedOcc 0
54 mol 266 unq 7 iso 0 dist 9.51145 9.90506 3.68488 10.3155 7.72861 10.9313 9.11585 5.95721 8.75066 7.80711 numMergedOcc 0
55 mol 266 unq 8 iso 0 dist 9.51145 9.90506 3.68488 4.39553 8.20376 6.96692 8.61077 3.14784 5.76129 8.25286 numMergedOcc 0
56 mol 266 unq 9 iso 0 dist 9.51145 9.90506 3.68488 4.39553 8.20376 6.96692 9.11585 5.95721 8.75066 9.9965 numMergedOcc 0
57 mol 266 unq 10 iso 0 dist 9.51145 8.61077 3.14784 10.3155 7.72861 7.8598 9.11585 5.95721 3.00605 7.80711 numMergedOcc 0
58 mol 266 unq 11 iso 0 dist 9.51145 8.61077 3.14784 4.39553 8.20376 8.25286 9.90506 3.68488 5.76129 6.96692 numMergedOcc 0
59 mol 266 unq 12 iso 0 dist 9.51145 8.61077 3.14784 4.39553 8.20376 8.25286 9.11585 5.95721 3.00605 9.9965 numMergedOcc 0
60 mol 266 unq 13 iso 0 dist 9.51145 9.11585 5.95721 10.3155 7.72861 7.80711 8.61077 3.14784 3.00605 7.8598 numMergedOcc 0
61 mol 266 unq 14 iso 0 dist 9.51145 9.11585 5.95721 4.39553 8.20376 9.9965 9.90506 3.68488 8.75066 6.96692 numMergedOcc 0
62 mol 266 unq 15 iso 0 dist 9.51145 9.11585 5.95721 4.39553 8.20376 9.9965 8.61077 3.14784 3.00605 8.25286 numMergedOcc 0
63 mol 287 unq 0 iso 0 dist 5.32839 8.39976 7.33038 5.15725 6.22311 11.983 7.82157 5.96434 13.001 6.24487 numMergedOcc 0
64 mol 288 unq 0 iso 0 dist 5.32839 8.39976 7.33038 5.15725 6.22311 11.983 7.82157 5.96434 13.001 6.24487 numMergedOcc 0
65 mol 289 unq 0 iso 0 dist 5.32839 8.39976 7.33038 5.15725 6.22311 11.983 7.82157 5.96434 13.001 6.24487 numMergedOcc 0
