0 mol 25 unq 0 iso 0 dist 8.40051 13.591 9.48085 6.29702 4.79873 12.7147 8.78181 6.08585 6.53269 9.35791 numMergedOcc 0
1 mol 25 unq 1 iso 0 dist 8.40051 13.591 9.48085 6.29702 4.79873 12.7147 10.9235 9.15781 9.81524 12.5177 numMergedOcc 0
2 mol 25 unq 2 iso 0 dist 8.6396 5.23233 6.55597 10.0172 7.52933 6.53015 8.78181 5.77929 9.16515 12.7995 numMergedOcc 0
3 mol 25 unq 3 iso 0 dist 8.6396 5.23233 6.55597 13.5673 9.71956 9.19736 8.78181 5.77929 9.16515 11.5214 numMergedOcc 0
4 mol 25 unq 4 iso 0 dist 8.6396 5.23233 6.55597 10.4709 7.07751 5.78812 8.78181 5.77929 9.16515 9.82987 numMergedOcc 0
5 mol 25 unq 5 iso 0 dist 8.6396 5.23233 6.55597 12.2787 8.23761 7.36721 8.78181 5.77929 9.16515 13.3492 numMergedOcc 0
6 mol 25 unq 6 iso 0 dist 8.6396 5.23233 6.55597 13.591 9.49421 12.1732 8.78181 5.77929 9.16515 6.53269 numMergedOcc 0
7 mol 25 unq 7 iso 0 dist 8.6396 10.4709 7.07751 10.0172 7.52933 8.64476 8.78181 5.77929 9.82987 12.7995 numMergedOcc 0
8 mol 25 unq 8 iso 0 dist 8.6396 10.4709 7.07751 5.23233 6.55597 5.78812 8.78181 5.77929 9.82987 9.16515 numMergedOcc 0
9 mol 25 unq 9 iso 0 dist 8.6396 10.4709 7.07751 13.5673 9.71956 3.56099 8.78181 5.77929 9.82987 11.5214 numMergedOcc 0
10 mol 25 unq 10 iso 0 dist 8.6396 10.4709 7.07751 12.2787 8.23761 5.99526 8.78181 5.77929 9.82987 13.3492 numMergedOcc 0
11 mol 25 unq 11 iso 0 dist 8.6396 10.4709 7.07751 13.591 9.49421 9.54872 8.78181 5.77929 9.82987 6.53269 numMergedOcc 0
12 mol 25 unq 12 iso 0 dist 8.6396 13.591 9.49421 10.0172 7.52933 16.0628 8.78181 5.77929 6.53269 12.7995 numMergedOcc 0
13 mol 25 unq 13 iso 0 dist 8.6396 13.591 9.49421 10.0172 7.52933 16.0628 10.9235 6.68639 9.81524 13.5372 numMergedOcc 0
14 mol 25 unq 14 iso 0 dist 8.6396 13.591 9.49421 5.23233 6.55597 12.1732 8.78181 5.77929 6.53269 9.16515 numMergedOcc 0
15 mol 25 unq 15 iso 0 dist 8.6396 13.591 9.49421 5.23233 6.55597 12.1732 10.9235 6.68639 9.81524 11.7789 numMergedOcc 0
16 mol 25 unq 16 iso 0 dist 8.6396 13.591 9.49421 13.5673 9.71956 8.99147 8.78181 5.77929 6.53269 11.5214 numMergedOcc 0
17 mol 25 unq 17 iso 0 dist 8.6396 13.591 9.49421 13.5673 9.71956 8.99147 10.9235 6.68639 9.81524 14.8131 numMergedOcc 0
18 mol 25 unq 18 iso 0 dist 8.6396 13.591 9.49421 10.4709 7.07751 9.54872 8.78181 5.77929 6.53269 9.82987 numMergedOcc 0
19 mol 25 unq 19 iso 0 dist 8.6396 13.591 9.49421 10.4709 7.07751 9.54872 10.9235 6.68639 9.81524 12.893 numMergedOcc 0
20 mol 25 unq 20 iso 0 dist 8.6396 13.591 9.49421 12.2787 8.23761 14.6175 8.78181 5.77929 6.53269 13.3492 numMergedOcc 0
21 mol 25 unq 21 iso 0 dist 8.6396 13.591 9.49421 12.2787 8.23761 14.6175 10.9235 6.68639 9.81524 14.9101 numMergedOcc 0
22 mol 58 unq 0 iso 0 dist 4.88613 4.99692 8.96727 3.70586 8.01308 6.20884 5.84625 5.49591 9.01564 7.11065 numMergedOcc 0
23 mol 58 unq 1 iso 0 dist 4.88613 3.70586 8.01308 4.99692 8.96727 6.20884 5.84625 5.49591 7.11065 9.01564 numMergedOcc 0
24 mol 73 unq 0 iso 0 dist 6.18305 4.21749 8.68662 5.65986 7.4369 3.30399 9.54477 6.56633 8.96616 6.14542 numMergedOcc 0
25 mol 73 unq 1 iso 0 dist 6.18305 5.65986 7.4369 4.21749 8.68662 3.30399 9.54477 6.56633 6.14542 8.96616 numMergedOcc 0
26 mol 112 unq 0 iso 0 dist 7.53905 3.61827 9.05166 3.78964 5.56994 5.11 5.42828 5.76986 8.72725 6.11407 numMergedOcc 0
27 mol 112 unq 1 iso 0 dist 7.53905 3.78964 5.56994 3.61827 9.05166 5.11 5.42828 5.76986 6.11407 8.72725 numMergedOcc 0
28 mol 129 unq 0 iso 0 dist 9.28278 9.05571 5.51197 9.63308 6.69691 5.94312 12.7577 4.92472 6.34626 10.0995 numMergedOcc 0
29 mol 129 unq 1 iso 0 dist 9.28278 9.05571 5.51197 14.5546 8.86944 9.74141 12.7577 4.92472 6.34626 11.4468 numMergedOcc 0
30 mol 134 unq 0 iso 0 dist 9.60411 3.76211 7.93372 11.6349 9.33924 11.4107 12.1527 5.29786 9.0176 12.2587 numMergedOcc 0
31 mol 181 unq 0 iso 0 dist 9.84952 7.19461 6.64173 9.77747 9.01624 11.196 13.401 5.63555 8.12266 10.5303 numMergedOcc 0
32 mol 181 unq 1 iso 0 dist 9.84952 7.19461 6.64173 10.0615 9.55105 10.1041 13.401 5.63555 8.12266 9.43306 numMergedOcc 0
33 mol 181 unq 2 iso 0 dist 9.84952 9.77747 9.01624 7.19461 6.64173 11.196 12.7332 7.20191 5.99437 12.6232 numMergedOcc 0
34 mol 181 unq 3 iso 0 dist 9.84952 9.77747 9.01624 10.0615 9.55105 3.55187 12.7332 7.20191 5.99437 8.4848 numMergedOcc 0
35 mol 181 unq 4 iso 0 dist 9.84952 10.0615 9.55105 7.19461 6.64173 10.1041 13.401 5.63555 9.43306 8.12266 numMergedOcc 0
36 mol 181 unq 5 iso 0 dist 9.84952 10.0615 9.55105 7.19461 6.64173 10.1041 12.7332 7.20191 8.4848 12.6232 numMergedOcc 0
37 mol 181 unq 6 iso 0 dist 9.84952 10.0615 9.55105 9.77747 9.01624 3.55187 13.401 5.63555 9.43306 10.5303 numMergedOcc 0
38 mol 181 unq 7 iso 0 dist 9.84952 10.0615 9.55105 9.77747 9.01624 3.55187 12.7332 7.20191 8.4848 5.99437 numMergedOcc 0
39 mol 186 unq 0 iso 0 dist 8.03995 11.8169 7.2793 14.1849 9.51091 3.47886 12.1826 10.5063 6.88127 9.90692 numMergedOcc 0
40 mol 186 unq 1 iso 0 dist 8.03995 11.8169 7.2793 3.85767 7.85184 12.5618 12.1826 10.5063 6.88127 14.7428 numMergedOcc 0
41 mol 222 unq 0 iso 0 dist 7.85877 4.91709 5.56538 5.96186 7.48954 3.58181 5.89818 7.75656 8.43195 8.23406 numMergedOcc 0
42 mol 222 unq 1 iso 0 dist 7.85877 5.96186 7.48954 4.91709 5.56538 3.58181 5.89818 7.75656 8.23406 8.43195 numMergedOcc 0
43 mol 274 unq 0 iso 0 dist 9.65265 18.3627 9.30212 11.4981 6.4611 13.5848 18.4464 9.5468 7.77765 9.65868 numMergedOcc 0
44 mol 274 unq 1 iso 0 dist 9.65265 11.4981 6.4611 18.3627 9.30212 13.5848 18.4464 9.5468 9.65868 7.77765 numMergedOcc 0
45 mol 274 unq 2 iso 0 dist 9.65265 11.4981 6.4611 18.3627 9.30212 13.5848 14.3742 6.70925 8.60027 10.0206 numMergedOcc 0
46 mol 277 unq 0 iso 0 dist 8.96343 6.17642 5.46926 8.24206 5.13913 3.39114 10.5 4.37645 9.26157 9.11117 numMergedOcc 0
47 mol 277 unq 1 iso 0 dist 9.29635 12.2421 8.9682 12.7269 9.35539 16.9644 16.1262 7.70529 9.26157 12.9467 numMergedOcc 0
48 mol 277 unq 2 iso 0 dist 9.29635 12.2421 8.9682 10.9521 6.92711 3.39114 16.1262 7.70529 9.26157 9.11117 numMergedOcc 0
49 mol 292 unq 0 iso 0 dist 9.20416 8.88312 7.20674 12.3704 8.38121 9.14614 16.222 8.83082 8.62162 10.8369 numMergedOcc 0
50 mol 292 unq 1 iso 0 dist 7.53641 10.0594 7.20674 15.5666 8.38121 9.14614 12.578 8.83082 8.62162 10.8369 numMergedOcc 0
