0 mol 7 unq 0 iso 0 dist 9.60499 6.02702 8.43473 6.55304 6.7985 6.14469 15.9584 13.2603 9.97624 13.0969 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 9.60499 6.02702 8.43473 12.2869 6.44736 9.97009 15.9584 13.2603 9.97624 11.9855 numMergedOcc 0
2 mol 15 unq 0 iso 0 dist 8.38064 7.48342 4.39605 4.29582 7.07399 6.03257 6.29685 10.2062 6.50647 6.19131 numMergedOcc 0
3 mol 19 unq 0 iso 0 dist 8.4674 8.40416 9.74255 4.64838 6.41575 9.95212 6.74265 9.58539 7.02548 5.90856 numMergedOcc 0
4 mol 19 unq 1 iso 0 dist 8.4674 6.41575 4.64838 9.74255 8.40416 9.95212 5.14627 6.20943 5.82366 11.4087 numMergedOcc 0
5 mol 19 unq 2 iso 0 dist 4.54938 7.75618 9.74255 4.97119 6.41575 9.95212 5.5841 9.58539 7.02548 5.90856 numMergedOcc 0
6 mol 19 unq 3 iso 0 dist 4.54938 6.41575 4.97119 9.74255 7.75618 9.95212 5.14627 7.82528 5.82366 11.4087 numMergedOcc 0
7 mol 19 unq 4 iso 0 dist 4.51865 8.40416 7.08342 4.64838 6.41423 9.95212 6.74265 8.58657 7.02548 5.90856 numMergedOcc 0
8 mol 19 unq 5 iso 0 dist 4.51865 6.41423 4.64838 7.08342 8.40416 9.95212 4.69858 6.20943 5.82366 11.4087 numMergedOcc 0
9 mol 19 unq 6 iso 0 dist 6.864 7.75618 7.08342 4.97119 6.41423 9.95212 5.5841 8.58657 7.02548 5.90856 numMergedOcc 0
10 mol 19 unq 7 iso 0 dist 6.864 6.41423 4.97119 7.08342 7.75618 9.95212 4.69858 7.82528 5.82366 11.4087 numMergedOcc 0
11 mol 25 unq 0 iso 0 dist 5.04899 9.01548 13.9331 5.77929 8.87757 8.88938 4.70708 9.43699 6.63839 6.06874 numMergedOcc 0
12 mol 25 unq 1 iso 0 dist 6.03987 6.85556 5.68392 5.82503 8.6653 12.0452 5.09159 10.7177 9.62401 8.95939 numMergedOcc 0
13 mol 54 unq 0 iso 0 dist 6.83299 6.14538 4.29856 13.86 7.21717 10.7227 5.06052 5.02241 6.30987 11.0681 numMergedOcc 0
14 mol 58 unq 0 iso 0 dist 6.86465 8.80614 10.2049 5.78774 9.92355 10.2007 13.9007 17.4911 7.6481 14.0642 numMergedOcc 0
15 mol 58 unq 1 iso 0 dist 6.86465 8.80614 10.2049 5.78774 9.92355 10.2007 6.47744 8.63333 9.11258 12.0055 numMergedOcc 0
16 mol 58 unq 2 iso 0 dist 6.62496 8.80614 9.95364 5.78774 5.93884 10.2007 13.9007 16.3613 7.6481 14.0642 numMergedOcc 0
17 mol 58 unq 3 iso 0 dist 6.62496 8.80614 9.95364 5.78774 5.93884 10.2007 6.47744 11.5023 9.11258 12.0055 numMergedOcc 0
18 mol 58 unq 4 iso 0 dist 6.35756 8.80614 5.49591 5.78774 7.68678 10.2007 13.9007 12.7237 7.6481 14.0642 numMergedOcc 0
19 mol 58 unq 5 iso 0 dist 6.35756 8.80614 5.49591 5.78774 7.68678 10.2007 6.47744 8.89374 9.11258 12.0055 numMergedOcc 0
20 mol 98 unq 0 iso 0 dist 5.08437 6.7117 7.06961 4.4057 6.65501 6.88901 8.70415 10.417 6.0129 5.71029 numMergedOcc 0
21 mol 98 unq 1 iso 0 dist 6.10456 4.47349 7.06961 9.67482 6.65501 6.88901 10.0962 10.417 6.0129 5.71029 numMergedOcc 0
22 mol 131 unq 0 iso 0 dist 6.85062 8.70296 14.2045 13.7237 9.90168 18.6956 7.90484 14.3377 9.2235 18.6498 numMergedOcc 0
23 mol 134 unq 0 iso 0 dist 9.89303 7.69991 4.60632 7.41674 5.83771 6.40575 6.69989 12.7291 8.55616 10.6595 numMergedOcc 0
24 mol 134 unq 1 iso 0 dist 9.89303 7.69991 4.60632 7.41674 5.83771 6.40575 10.1448 12.0514 8.73604 14.1488 numMergedOcc 0
25 mol 134 unq 2 iso 0 dist 6.54501 7.69991 5.71679 7.41674 7.80532 6.40575 6.69989 10.9685 8.55616 10.6595 numMergedOcc 0
26 mol 134 unq 3 iso 0 dist 6.54501 7.69991 5.71679 7.41674 7.80532 6.40575 10.1448 8.6355 8.73604 14.1488 numMergedOcc 0
27 mol 134 unq 4 iso 0 dist 6.49416 6.23142 5.71679 9.87376 7.80532 6.40575 5.3585 10.9685 8.55616 10.6595 numMergedOcc 0
28 mol 134 unq 5 iso 0 dist 6.49416 6.23142 5.71679 9.87376 7.80532 6.40575 5.41704 8.6355 8.73604 14.1488 numMergedOcc 0
29 mol 156 unq 0 iso 0 dist 7.44554 9.44367 5.4555 5.71511 9.4013 8.37434 7.29758 6.27641 5.81122 5.05683 numMergedOcc 0
30 mol 156 unq 1 iso 0 dist 8.94056 7.90267 5.4555 6.13574 9.4013 8.37434 8.67156 6.27641 5.81122 5.05683 numMergedOcc 0
31 mol 181 unq 0 iso 0 dist 9.1374 8.90963 8.91338 6.6251 6.2479 12.1629 8.25067 13.2702 5.95304 14.048 numMergedOcc 0
32 mol 181 unq 1 iso 0 dist 9.1374 6.2479 6.6251 8.91338 8.90963 12.1629 6.25083 6.94688 9.06217 4.43678 numMergedOcc 0
33 mol 181 unq 2 iso 0 dist 9.1374 6.2479 6.6251 8.91338 8.90963 12.1629 4.77278 6.71012 7.13252 6.03415 numMergedOcc 0
34 mol 181 unq 3 iso 0 dist 8.03334 6.59025 8.04639 7.81713 6.2479 8.86197 7.07409 10.7636 6.32777 7.23063 numMergedOcc 0
35 mol 181 unq 4 iso 0 dist 8.03334 6.2479 7.81713 4.43096 6.46704 7.32087 6.25083 12.1309 9.06217 10.6325 numMergedOcc 0
36 mol 181 unq 5 iso 0 dist 8.03334 6.2479 7.81713 4.43096 6.46704 7.32087 4.77278 12.2058 7.13252 8.45963 numMergedOcc 0
37 mol 181 unq 6 iso 0 dist 8.03334 6.2479 7.81713 8.04639 6.59025 8.86197 6.25083 12.1309 9.06217 8.15174 numMergedOcc 0
38 mol 181 unq 7 iso 0 dist 8.03334 6.2479 7.81713 8.04639 6.59025 8.86197 4.77278 12.2058 7.13252 11.047 numMergedOcc 0
39 mol 181 unq 8 iso 0 dist 5.98885 8.90963 9.81073 5.6044 9.72611 10.515 8.25067 10.8351 5.95304 6.27947 numMergedOcc 0
40 mol 181 unq 9 iso 0 dist 5.98885 8.90963 9.81073 6.6251 7.99195 12.1629 8.25067 10.8351 5.95304 14.048 numMergedOcc 0
41 mol 181 unq 10 iso 0 dist 5.98885 7.99195 6.6251 9.81073 8.90963 12.1629 5.86342 6.94688 9.06217 4.43678 numMergedOcc 0
42 mol 181 unq 11 iso 0 dist 5.98885 7.99195 6.6251 9.81073 8.90963 12.1629 9.14057 6.71012 7.13252 6.03415 numMergedOcc 0
43 mol 181 unq 12 iso 0 dist 7.81386 5.94469 7.77758 7.20191 9.39829 11.8933 6.7991 4.93785 7.05653 7.30555 numMergedOcc 0
44 mol 181 unq 13 iso 0 dist 7.63312 5.9176 5.63555 12.5387 5.94469 10.3104 9.60512 7.98142 5.97685 8.93991 numMergedOcc 0
45 mol 181 unq 14 iso 0 dist 7.63312 5.9176 5.63555 12.5387 5.94469 10.3104 13.3389 7.37327 8.9289 5.35588 numMergedOcc 0
46 mol 181 unq 15 iso 0 dist 7.63312 5.94469 12.5387 5.63555 5.9176 10.3104 6.7991 10.1232 7.05653 11.5017 numMergedOcc 0
47 mol 181 unq 16 iso 0 dist 7.63312 5.94469 12.5387 7.20191 6.41453 11.8933 6.7991 10.1232 7.05653 7.30555 numMergedOcc 0
48 mol 232 unq 0 iso 0 dist 8.27212 9.40808 4.9377 8.80479 9.05071 9.8664 13.5597 11.4727 7.17337 16.1253 numMergedOcc 0
49 mol 264 unq 0 iso 0 dist 6.24356 5.93616 7.52936 5.00209 7.16853 10.3854 5.12409 9.0012 5.91213 9.76317 numMergedOcc 0
50 mol 264 unq 1 iso 0 dist 6.24356 5.93616 7.52936 5.00209 7.16853 10.3854 9.67998 9.5784 7.34094 13.9064 numMergedOcc 0
