0 mol 54 unq 0 iso 0 dist 6.10175 5.65405 5.59773 10.4186 5.42328 6.59893 14.4402 13.9079 9.5589 11.9881 numMergedOcc 0
1 mol 54 unq 1 iso 0 dist 6.10175 5.65405 5.59773 10.4186 5.42328 6.59893 10.5929 10.4238 6.83299 10.3564 numMergedOcc 0
2 mol 54 unq 2 iso 0 dist 6.10175 5.65405 5.59773 10.4186 5.42328 6.59893 6.54183 10.1356 8.10861 12.4254 numMergedOcc 0
3 mol 60 unq 0 iso 0 dist 4.96897 6.96065 5.83937 12.1582 10.9023 8.82095 9.92844 6.62193 6.65595 5.63638 numMergedOcc 0
4 mol 60 unq 1 iso 0 dist 4.96897 6.96065 5.83937 12.1582 10.9023 8.82095 14.2472 10.9885 9.25011 5.95814 numMergedOcc 0
5 mol 60 unq 2 iso 0 dist 4.96897 6.96065 5.83937 12.1582 10.9023 8.82095 12.177 9.96073 6.43294 13.6099 numMergedOcc 0
6 mol 60 unq 3 iso 0 dist 4.96897 6.96065 5.83937 12.1582 10.9023 8.82095 14.7815 11.2445 8.52121 12.0142 numMergedOcc 0
7 mol 61 unq 0 iso 0 dist 6.85094 7.15161 5.92705 12.8266 8.0979 9.62468 10.5531 5.4671 6.65721 10.7369 numMergedOcc 0
8 mol 61 unq 1 iso 0 dist 6.85094 7.15161 5.92705 12.8266 8.0979 9.62468 13.6393 10.1513 6.72123 11.5608 numMergedOcc 0
9 mol 61 unq 2 iso 0 dist 9.94756 18.7183 9.62468 17.9242 8.0979 5.92705 20.4711 10.7369 6.65721 5.4671 numMergedOcc 0
10 mol 61 unq 3 iso 0 dist 9.94756 18.7183 9.62468 17.9242 8.0979 5.92705 19.7171 11.5608 6.72123 10.1513 numMergedOcc 0
11 mol 73 unq 0 iso 0 dist 7.84699 13.4367 6.89722 8.40844 5.47475 7.26679 10.1112 10.4716 9.96396 8.31041 numMergedOcc 0
12 mol 73 unq 1 iso 0 dist 7.84699 13.4367 6.89722 8.40844 5.47475 7.26679 8.124 5.2774 6.19304 5.44275 numMergedOcc 0
13 mol 73 unq 2 iso 0 dist 7.84699 13.4367 6.89722 8.40844 5.47475 7.26679 19.5696 13.9156 8.70481 11.2674 numMergedOcc 0
14 mol 73 unq 3 iso 0 dist 8.40844 5.33851 9.68526 6.99156 4.4628 9.72442 10.1112 8.31041 9.38498 11.7069 numMergedOcc 0
15 mol 73 unq 4 iso 0 dist 8.40844 13.4367 7.26679 7.84699 5.47475 6.89722 10.1112 8.31041 9.96396 10.4716 numMergedOcc 0
16 mol 73 unq 5 iso 0 dist 8.40844 13.4367 7.26679 7.84699 5.47475 6.89722 8.124 5.44275 6.19304 5.2774 numMergedOcc 0
17 mol 73 unq 6 iso 0 dist 8.40844 13.4367 7.26679 7.84699 5.47475 6.89722 19.5696 11.2674 8.70481 13.9156 numMergedOcc 0
18 mol 73 unq 7 iso 0 dist 6.99156 5.33851 9.72442 8.40844 4.4628 9.68526 10.1112 11.7069 9.38498 8.31041 numMergedOcc 0
19 mol 73 unq 8 iso 0 dist 7.02351 13.6586 9.68526 10.4593 4.4628 9.72442 11.0108 8.31041 9.38498 11.7069 numMergedOcc 0
20 mol 73 unq 9 iso 0 dist 7.02351 10.3774 7.26679 12.1654 5.47475 6.89722 11.0108 8.31041 9.96396 10.4716 numMergedOcc 0
21 mol 73 unq 10 iso 0 dist 7.02351 10.3774 7.26679 12.1654 5.47475 6.89722 10.9082 5.44275 6.19304 5.2774 numMergedOcc 0
22 mol 73 unq 11 iso 0 dist 7.02351 10.3774 7.26679 12.1654 5.47475 6.89722 8.16299 11.2674 8.70481 13.9156 numMergedOcc 0
23 mol 73 unq 12 iso 0 dist 7.53504 9.64124 6.89722 8.66342 5.47475 7.26679 16.3948 10.4716 9.96396 8.31041 numMergedOcc 0
24 mol 73 unq 13 iso 0 dist 7.53504 9.64124 6.89722 8.66342 5.47475 7.26679 11.801 5.2774 6.19304 5.44275 numMergedOcc 0
25 mol 73 unq 14 iso 0 dist 7.53504 9.64124 6.89722 8.66342 5.47475 7.26679 12.2721 13.9156 8.70481 11.2674 numMergedOcc 0
26 mol 73 unq 15 iso 0 dist 8.66342 16.8585 9.68526 7.21285 4.4628 9.72442 16.3948 8.31041 9.38498 11.7069 numMergedOcc 0
27 mol 73 unq 16 iso 0 dist 8.66342 9.64124 7.26679 7.53504 5.47475 6.89722 16.3948 8.31041 9.96396 10.4716 numMergedOcc 0
28 mol 73 unq 17 iso 0 dist 8.66342 9.64124 7.26679 7.53504 5.47475 6.89722 11.801 5.44275 6.19304 5.2774 numMergedOcc 0
29 mol 73 unq 18 iso 0 dist 8.66342 9.64124 7.26679 7.53504 5.47475 6.89722 12.2721 11.2674 8.70481 13.9156 numMergedOcc 0
30 mol 73 unq 19 iso 0 dist 7.21285 16.8585 9.72442 8.66342 4.4628 9.68526 16.3948 11.7069 9.38498 8.31041 numMergedOcc 0
31 mol 102 unq 0 iso 0 dist 9.61113 13.9809 9.01767 7.59973 7.56811 9.80678 12.1389 6.42572 7.36792 5.54551 numMergedOcc 0
32 mol 102 unq 1 iso 0 dist 7.59973 13.9809 9.80678 9.61113 7.56811 9.01767 12.1389 5.54551 7.36792 6.42572 numMergedOcc 0
33 mol 102 unq 2 iso 0 dist 7.73836 5.09542 9.01767 10.8539 7.56811 9.80678 9.84673 6.42572 7.36792 5.54551 numMergedOcc 0
34 mol 130 unq 0 iso 0 dist 8.26291 10.9365 7.83619 17.9497 15.0214 9.91643 13.2314 10.0837 9.28393 7.40242 numMergedOcc 0
35 mol 130 unq 1 iso 0 dist 7.86001 5.63567 7.83619 13.5796 15.0214 9.91643 12.6804 10.0837 9.28393 7.40242 numMergedOcc 0
36 mol 131 unq 0 iso 0 dist 5.50364 5.29825 8.97145 8.7301 8.09035 6.5874 12.0117 14.257 6.85062 7.60371 numMergedOcc 0
37 mol 131 unq 1 iso 0 dist 8.7301 5.29825 6.5874 5.50364 8.09035 8.97145 12.0117 7.60371 6.85062 14.257 numMergedOcc 0
38 mol 181 unq 0 iso 0 dist 4.35909 5.32859 7.44191 5.77393 8.67658 6.00053 11.0615 9.60754 8.03334 11.1879 numMergedOcc 0
39 mol 181 unq 1 iso 0 dist 5.77393 5.32859 6.00053 4.35909 8.67658 7.44191 11.0615 11.1879 8.03334 9.60754 numMergedOcc 0
40 mol 224 unq 0 iso 0 dist 7.46044 13.1803 9.75313 17.2648 11.6002 6.08709 10.6043 6.46679 6.61986 7.85135 numMergedOcc 0
41 mol 224 unq 1 iso 0 dist 4.99301 5.25583 6.56437 6.36813 6.35724 6.23882 13.0296 14.2632 8.95269 15.0038 numMergedOcc 0
42 mol 224 unq 2 iso 0 dist 4.99301 5.25583 6.56437 13.3762 10.9885 9.53131 13.0296 14.2632 8.95269 9.59595 numMergedOcc 0
43 mol 224 unq 3 iso 0 dist 4.99301 5.25583 6.56437 14.4875 14.4585 9.34636 13.0296 14.2632 8.95269 5.63485 numMergedOcc 0
44 mol 224 unq 4 iso 0 dist 6.36813 5.25583 6.23882 4.99301 6.35724 6.56437 13.0296 15.0038 8.95269 14.2632 numMergedOcc 0
45 mol 224 unq 5 iso 0 dist 6.36813 5.25583 6.23882 13.3762 13.2305 9.53131 13.0296 15.0038 8.95269 9.59595 numMergedOcc 0
46 mol 224 unq 6 iso 0 dist 6.36813 5.25583 6.23882 14.4875 14.027 9.34636 13.0296 15.0038 8.95269 5.63485 numMergedOcc 0
47 mol 224 unq 7 iso 0 dist 7.7163 11.8217 9.34636 18.3068 14.4585 6.56437 7.07564 5.63485 8.95269 14.2632 numMergedOcc 0
48 mol 224 unq 8 iso 0 dist 7.7163 11.8217 9.34636 16.4902 14.027 6.23882 7.07564 5.63485 8.95269 15.0038 numMergedOcc 0
49 mol 224 unq 9 iso 0 dist 7.7163 11.8217 9.34636 14.6367 7.4034 9.53131 7.07564 5.63485 8.95269 9.59595 numMergedOcc 0
50 mol 224 unq 10 iso 0 dist 9.06201 11.9904 9.34636 18.2476 14.4585 6.56437 10.9817 5.63485 8.95269 14.2632 numMergedOcc 0
51 mol 224 unq 11 iso 0 dist 9.06201 11.9904 9.34636 14.6984 14.027 6.23882 10.9817 5.63485 8.95269 15.0038 numMergedOcc 0
52 mol 224 unq 12 iso 0 dist 9.06201 11.9904 9.34636 15.6258 7.4034 9.53131 10.9817 5.63485 8.95269 9.59595 numMergedOcc 0
53 mol 249 unq 0 iso 0 dist 5.66519 8.68833 7.29898 6.50067 5.2966 8.91685 10.291 6.6173 7.57994 5.25611 numMergedOcc 0
54 mol 249 unq 1 iso 0 dist 5.66519 8.68833 7.29898 6.50067 5.2966 8.91685 12.7977 8.95486 6.18582 9.66184 numMergedOcc 0
55 mol 249 unq 2 iso 0 dist 6.50067 8.68833 8.91685 5.66519 5.2966 7.29898 10.291 5.25611 7.57994 6.6173 numMergedOcc 0
56 mol 249 unq 3 iso 0 dist 6.50067 8.68833 8.91685 5.66519 5.2966 7.29898 12.7977 9.66184 6.18582 8.95486 numMergedOcc 0
57 mol 274 unq 0 iso 0 dist 5.68643 7.48637 9.91395 12.136 10.3541 7.80446 8.78883 4.97216 9.10818 6.57235 numMergedOcc 0
58 mol 274 unq 1 iso 0 dist 8.17922 10.374 7.80446 14.8666 10.3541 9.91395 13.261 6.57235 9.10818 4.97216 numMergedOcc 0
59 mol 282 unq 0 iso 0 dist 6.40686 4.89059 5.67266 7.14443 6.38894 5.80981 12.7745 9.63727 8.04483 9.60898 numMergedOcc 0
60 mol 282 unq 1 iso 0 dist 6.40686 4.89059 5.67266 7.14443 6.38894 5.80981 10.161 4.58403 8.76532 10.5698 numMergedOcc 0
61 mol 282 unq 2 iso 0 dist 6.40686 4.89059 5.67266 7.14443 6.38894 5.80981 9.83042 5.04235 6.33524 8.37652 numMergedOcc 0
62 mol 282 unq 3 iso 0 dist 6.40686 4.89059 5.67266 14.4248 12.9312 9.63346 12.7745 9.63727 8.04483 4.85461 numMergedOcc 0
63 mol 282 unq 4 iso 0 dist 6.40686 4.89059 5.67266 14.4248 12.9312 9.63346 10.161 4.58403 8.76532 13.108 numMergedOcc 0
64 mol 282 unq 5 iso 0 dist 6.40686 4.89059 5.67266 14.4248 12.9312 9.63346 9.83042 5.04235 6.33524 8.85797 numMergedOcc 0
65 mol 282 unq 6 iso 0 dist 7.14443 4.89059 5.80981 6.40686 6.38894 5.67266 12.7745 9.60898 8.04483 9.63727 numMergedOcc 0
66 mol 282 unq 7 iso 0 dist 7.14443 4.89059 5.80981 6.40686 6.38894 5.67266 10.161 10.5698 8.76532 4.58403 numMergedOcc 0
67 mol 282 unq 8 iso 0 dist 7.14443 4.89059 5.80981 6.40686 6.38894 5.67266 9.83042 8.37652 6.33524 5.04235 numMergedOcc 0
68 mol 282 unq 9 iso 0 dist 7.14443 4.89059 5.80981 14.4248 12.8857 9.63346 12.7745 9.60898 8.04483 4.85461 numMergedOcc 0
69 mol 282 unq 10 iso 0 dist 7.14443 4.89059 5.80981 14.4248 12.8857 9.63346 10.161 10.5698 8.76532 13.108 numMergedOcc 0
70 mol 282 unq 11 iso 0 dist 7.14443 4.89059 5.80981 14.4248 12.8857 9.63346 9.83042 8.37652 6.33524 8.85797 numMergedOcc 0
