0 mol 5 unq 0 iso 0 dist 9.22067 7.56866 5.30421 14.5394 8.49537 13.6912 6.62108 9.70883 8.68577 14.7887 numMergedOcc 0
1 mol 5 unq 1 iso 0 dist 9.22067 7.56866 5.30421 14.5394 8.49537 13.6912 6.81491 11.5358 8.13672 18.2845 numMergedOcc 0
2 mol 28 unq 0 iso 0 dist 9.28621 8.51428 8.67111 12.5255 8.94643 15.9319 7.50035 11.286 9.89219 12.0148 numMergedOcc 0
3 mol 28 unq 1 iso 0 dist 9.28621 8.51428 8.67111 9.40652 8.36195 13.7143 7.50035 11.286 9.89219 15.1532 numMergedOcc 0
4 mol 28 unq 2 iso 0 dist 8.09862 5.42412 3.70336 16.4082 8.97167 12.664 9.64948 7.08766 8.53424 10.1805 numMergedOcc 0
5 mol 28 unq 3 iso 0 dist 8.09862 8.89114 3.0988 16.4082 8.97167 8.8182 9.64948 7.08766 4.82199 10.1805 numMergedOcc 0
6 mol 28 unq 4 iso 0 dist 8.97167 8.8182 3.0988 16.4082 8.09862 8.89114 10.1805 7.08766 4.82199 9.64948 numMergedOcc 0
7 mol 28 unq 5 iso 0 dist 8.89114 5.42412 5.1533 16.4082 8.8182 12.664 9.64948 4.82199 8.53424 10.1805 numMergedOcc 0
8 mol 28 unq 6 iso 0 dist 8.89114 8.09862 3.0988 16.4082 8.8182 8.97167 9.64948 4.82199 7.08766 10.1805 numMergedOcc 0
9 mol 28 unq 7 iso 0 dist 8.8182 8.97167 3.0988 16.4082 8.89114 8.09862 10.1805 4.82199 7.08766 9.64948 numMergedOcc 0
10 mol 30 unq 0 iso 0 dist 9.71995 9.11745 11.1844 9.60272 6.93011 15.768 3.90342 11.3258 9.63882 11.2453 numMergedOcc 0
11 mol 30 unq 1 iso 0 dist 9.71995 4.62145 11.2187 9.60272 6.93011 13.1928 3.90342 11.3258 6.87277 11.2453 numMergedOcc 0
12 mol 48 unq 0 iso 0 dist 7.33788 9.74351 4.78728 5.43494 8.52681 9.98769 3.85292 4.22002 8.10774 6.44604 numMergedOcc 0
13 mol 48 unq 1 iso 0 dist 7.33788 7.36877 5.61785 5.43494 8.52681 10.9073 6.64874 9.83205 5.54472 10.6872 numMergedOcc 0
14 mol 48 unq 2 iso 0 dist 7.33788 7.36877 5.61785 5.43494 8.52681 10.9073 5.68077 11.444 8.62369 9.24728 numMergedOcc 0
15 mol 48 unq 3 iso 0 dist 7.33788 7.36877 5.61785 5.43494 8.52681 10.9073 3.85292 4.22002 6.5241 6.44604 numMergedOcc 0
16 mol 48 unq 4 iso 0 dist 9.74351 7.33788 4.78728 5.43494 9.98769 8.52681 7.0331 13.4006 8.96151 10.4499 numMergedOcc 0
17 mol 48 unq 5 iso 0 dist 9.74351 7.33788 4.78728 5.43494 9.98769 8.52681 3.85292 8.10774 4.22002 6.44604 numMergedOcc 0
18 mol 48 unq 6 iso 0 dist 9.74351 7.36877 6.20957 5.43494 9.98769 10.9073 6.64874 9.84914 5.54472 10.6872 numMergedOcc 0
19 mol 48 unq 7 iso 0 dist 9.74351 7.36877 6.20957 5.43494 9.98769 10.9073 5.68077 11.9942 8.62369 9.24728 numMergedOcc 0
20 mol 48 unq 8 iso 0 dist 9.74351 7.36877 6.20957 5.43494 9.98769 10.9073 3.85292 8.10774 6.5241 6.44604 numMergedOcc 0
21 mol 48 unq 9 iso 0 dist 7.36877 7.33788 5.61785 5.13868 9.55284 10.6828 7.0331 10.2447 8.96151 12.0836 numMergedOcc 0
22 mol 48 unq 10 iso 0 dist 7.36877 7.33788 5.61785 5.13868 9.55284 10.6828 3.85292 6.5241 4.22002 8.48678 numMergedOcc 0
23 mol 48 unq 11 iso 0 dist 7.36877 9.74351 6.20957 5.13868 9.55284 10.9118 3.85292 6.5241 8.10774 8.48678 numMergedOcc 0
24 mol 48 unq 12 iso 0 dist 8.52681 9.98769 4.78728 5.43494 7.33788 9.74351 6.44604 4.22002 8.10774 3.85292 numMergedOcc 0
25 mol 48 unq 13 iso 0 dist 9.98769 8.52681 4.78728 5.43494 9.74351 7.33788 10.4499 13.4006 8.96151 7.0331 numMergedOcc 0
26 mol 48 unq 14 iso 0 dist 9.98769 8.52681 4.78728 5.43494 9.74351 7.33788 6.44604 8.10774 4.22002 3.85292 numMergedOcc 0
27 mol 48 unq 15 iso 0 dist 9.21776 6.89752 6.29252 5.56042 9.40291 10.6705 6.42565 9.29472 5.37439 10.5404 numMergedOcc 0
28 mol 48 unq 16 iso 0 dist 9.21776 6.89752 6.29252 5.56042 9.40291 10.6705 5.7824 11.3622 8.3714 9.35478 numMergedOcc 0
29 mol 48 unq 17 iso 0 dist 9.21776 6.89752 6.29252 5.56042 9.40291 10.6705 3.72746 8.14245 6.36817 6.4561 numMergedOcc 0
30 mol 48 unq 18 iso 0 dist 9.21776 6.85843 4.73799 5.56042 9.40291 7.94814 3.72746 8.14245 4.17933 6.4561 numMergedOcc 0
31 mol 48 unq 19 iso 0 dist 6.85843 9.21776 4.73799 5.56042 7.94814 9.40291 3.72746 4.17933 8.14245 6.4561 numMergedOcc 0
32 mol 48 unq 20 iso 0 dist 6.85843 6.89752 5.553 5.56042 7.94814 10.6705 6.42565 9.47823 5.37439 10.5404 numMergedOcc 0
33 mol 48 unq 21 iso 0 dist 6.85843 6.89752 5.553 5.56042 7.94814 10.6705 5.7824 11.095 8.3714 9.35478 numMergedOcc 0
34 mol 48 unq 22 iso 0 dist 6.85843 6.89752 5.553 5.56042 7.94814 10.6705 3.72746 4.17933 6.36817 6.4561 numMergedOcc 0
35 mol 48 unq 23 iso 0 dist 9.40291 7.94814 4.73799 5.56042 9.21776 6.85843 6.4561 8.14245 4.17933 3.72746 numMergedOcc 0
36 mol 48 unq 24 iso 0 dist 9.40291 9.55632 7.19576 5.56042 9.21776 9.03709 6.4561 8.14245 5.54893 3.72746 numMergedOcc 0
37 mol 48 unq 25 iso 0 dist 7.94814 9.40291 4.73799 5.56042 6.85843 9.21776 6.4561 4.17933 8.14245 3.72746 numMergedOcc 0
38 mol 48 unq 26 iso 0 dist 7.94814 9.55632 3.18526 5.56042 6.85843 9.03709 6.4561 4.17933 5.54893 3.72746 numMergedOcc 0
39 mol 85 unq 0 iso 0 dist 8.67342 8.60062 2.58673 9.06957 5.73739 5.16225 7.55572 10.9264 9.09711 8.41797 numMergedOcc 0
40 mol 85 unq 1 iso 0 dist 8.67342 8.60062 2.58673 9.06957 5.73739 5.16225 10.9585 10.4386 7.91193 9.0874 numMergedOcc 0
41 mol 85 unq 2 iso 0 dist 8.67342 8.60062 2.58673 9.06957 5.73739 5.16225 11.1042 9.52926 7.07839 10.0529 numMergedOcc 0
42 mol 85 unq 3 iso 0 dist 8.67342 8.60062 2.58673 9.06957 5.73739 5.16225 4.8069 6.67137 7.04244 10.0178 numMergedOcc 0
43 mol 85 unq 4 iso 0 dist 8.67342 8.60062 2.58673 9.06957 5.73739 5.16225 18.1303 9.78707 9.63449 12.1664 numMergedOcc 0
44 mol 85 unq 5 iso 0 dist 8.60062 8.67342 2.58673 9.06957 5.16225 5.73739 4.8069 7.04244 6.67137 10.0178 numMergedOcc 0
45 mol 85 unq 6 iso 0 dist 8.60062 8.67342 2.58673 9.06957 5.16225 5.73739 18.1303 9.63449 9.78707 12.1664 numMergedOcc 0
46 mol 85 unq 7 iso 0 dist 5.73739 5.16225 2.58673 9.06957 8.67342 8.60062 10.0529 9.52926 7.07839 11.1042 numMergedOcc 0
47 mol 85 unq 8 iso 0 dist 5.73739 5.16225 2.58673 9.06957 8.67342 8.60062 8.41797 10.9264 9.09711 7.55572 numMergedOcc 0
48 mol 85 unq 9 iso 0 dist 5.73739 5.16225 2.58673 9.06957 8.67342 8.60062 9.0874 10.4386 7.91193 10.9585 numMergedOcc 0
49 mol 85 unq 10 iso 0 dist 5.73739 5.16225 2.58673 9.06957 8.67342 8.60062 10.0178 6.67137 7.04244 4.8069 numMergedOcc 0
50 mol 85 unq 11 iso 0 dist 5.73739 5.16225 2.58673 9.06957 8.67342 8.60062 12.1664 9.78707 9.63449 18.1303 numMergedOcc 0
51 mol 85 unq 12 iso 0 dist 5.16225 5.73739 2.58673 9.06957 8.60062 8.67342 10.0178 7.04244 6.67137 4.8069 numMergedOcc 0
52 mol 85 unq 13 iso 0 dist 5.16225 5.73739 2.58673 9.06957 8.60062 8.67342 12.1664 9.63449 9.78707 18.1303 numMergedOcc 0
53 mol 193 unq 0 iso 0 dist 9.50113 9.73679 14.6395 13.7578 9.00084 20.5012 4.8988 12.6747 8.30069 15.3742 numMergedOcc 0
54 mol 230 unq 0 iso 0 dist 9.73038 9.62914 13.2396 9.462 7.51295 17.4112 3.86973 11.6163 9.47092 11.28 numMergedOcc 0
55 mol 266 unq 0 iso 0 dist 9.90506 8.61077 5.76129 5.6921 9.03341 10.9833 10.3155 10.9313 7.8598 12.338 numMergedOcc 0
56 mol 266 unq 1 iso 0 dist 9.90506 8.61077 5.76129 5.6921 9.03341 10.9833 4.39553 6.96692 8.25286 3.94797 numMergedOcc 0
57 mol 266 unq 2 iso 0 dist 9.90506 9.11585 8.75066 5.6921 9.03341 12.7605 10.3155 10.9313 7.80711 12.338 numMergedOcc 0
58 mol 266 unq 3 iso 0 dist 9.90506 9.11585 8.75066 5.6921 9.03341 12.7605 4.39553 6.96692 9.9965 3.94797 numMergedOcc 0
59 mol 266 unq 4 iso 0 dist 6.39822 5.36518 3.00605 5.40028 8.61077 9.11585 10.1418 7.8598 7.80711 10.3155 numMergedOcc 0
60 mol 266 unq 5 iso 0 dist 6.39822 5.36518 3.00605 5.40028 8.61077 9.11585 7.63149 8.25286 9.9965 4.39553 numMergedOcc 0
61 mol 266 unq 6 iso 0 dist 8.61077 9.90506 5.76129 5.40028 6.39822 10.3444 4.39553 8.25286 6.96692 7.63149 numMergedOcc 0
62 mol 266 unq 7 iso 0 dist 8.61077 9.11585 3.00605 5.40028 6.39822 5.36518 10.3155 7.8598 7.80711 10.1418 numMergedOcc 0
63 mol 266 unq 8 iso 0 dist 8.61077 9.11585 3.00605 5.40028 6.39822 5.36518 4.39553 8.25286 9.9965 7.63149 numMergedOcc 0
64 mol 266 unq 9 iso 0 dist 5.36518 6.39822 3.00605 5.40028 9.11585 8.61077 10.1418 7.80711 7.8598 10.3155 numMergedOcc 0
65 mol 266 unq 10 iso 0 dist 5.36518 6.39822 3.00605 5.40028 9.11585 8.61077 7.63149 9.9965 8.25286 4.39553 numMergedOcc 0
66 mol 266 unq 11 iso 0 dist 9.11585 9.90506 8.75066 5.40028 5.36518 10.3444 4.39553 9.9965 6.96692 7.63149 numMergedOcc 0
67 mol 266 unq 12 iso 0 dist 9.11585 8.61077 3.00605 5.40028 5.36518 6.39822 10.3155 7.80711 7.8598 10.1418 numMergedOcc 0
68 mol 266 unq 13 iso 0 dist 9.11585 8.61077 3.00605 5.40028 5.36518 6.39822 4.39553 9.9965 8.25286 7.63149 numMergedOcc 0
69 mol 277 unq 0 iso 0 dist 8.90967 6.40861 3.75238 15.2073 9.07744 12.4905 5.91105 6.79748 6.53598 10.4629 numMergedOcc 0
70 mol 277 unq 1 iso 0 dist 8.90967 6.40861 3.75238 15.6008 8.42892 9.71221 5.91105 6.79748 6.53598 12.6492 numMergedOcc 0
71 mol 281 unq 0 iso 0 dist 9.06888 6.62682 3.77058 15.6382 9.39268 12.8134 6.24691 8.70938 5.33372 17.6912 numMergedOcc 0
72 mol 281 unq 1 iso 0 dist 9.06888 6.62682 3.77058 15.6382 9.39268 12.8134 6.28551 6.69267 6.56886 10.4439 numMergedOcc 0
