0 mol 73 unq 0 iso 0 dist 8.06168 10.8798 5.61588 15.4463 8.07446 5.5087 13.7119 5.9144 8.46627 6.41115 numMergedOcc 0
1 mol 73 unq 1 iso 0 dist 8.06168 13.7267 7.83244 15.4463 8.07446 6.08682 13.7119 5.9144 9.22208 6.41115 numMergedOcc 0
2 mol 73 unq 2 iso 0 dist 8.67532 10.8441 5.61588 12.1964 8.07446 5.5087 9.762 5.9144 8.46627 6.41115 numMergedOcc 0
3 mol 73 unq 3 iso 0 dist 8.67532 15.2203 7.83244 12.1964 8.07446 6.08682 9.762 5.9144 9.22208 6.41115 numMergedOcc 0
4 mol 76 unq 0 iso 0 dist 8.58841 16.3337 9.85905 17.86 10.2879 6.72869 22.3883 15.4159 9.59729 5.31985 numMergedOcc 0
5 mol 112 unq 0 iso 0 dist 5.17585 3.82552 4.22363 10.5503 6.34999 7.7988 9.58064 9.05551 6.96745 11.0625 numMergedOcc 0
6 mol 112 unq 1 iso 0 dist 5.17585 3.82552 4.22363 10.5069 6.72751 9.40824 9.58064 9.05551 6.96745 14.5726 numMergedOcc 0
7 mol 115 unq 0 iso 0 dist 5.02717 12.6105 9.42082 12.5189 7.69052 6.39384 9.5681 6.01673 7.65564 6.95773 numMergedOcc 0
8 mol 134 unq 0 iso 0 dist 9.92932 3.76211 7.21868 13.0095 5.62899 9.66543 12.3555 7.41373 8.62504 4.46337 numMergedOcc 0
9 mol 134 unq 1 iso 0 dist 9.92932 3.76211 7.21868 9.60411 5.49782 7.93372 12.3555 7.41373 8.62504 10.8635 numMergedOcc 0
10 mol 134 unq 2 iso 0 dist 9.60411 3.76211 7.93372 13.0095 10.7144 9.66543 12.3555 10.8635 8.62504 4.46337 numMergedOcc 0
11 mol 134 unq 3 iso 0 dist 9.60411 3.76211 7.93372 9.92932 5.49782 7.21868 12.3555 10.8635 8.62504 7.41373 numMergedOcc 0
12 mol 134 unq 4 iso 0 dist 9.60369 4.63732 9.66543 9.55556 5.62899 7.21868 8.78303 4.46337 8.62504 7.41373 numMergedOcc 0
13 mol 134 unq 5 iso 0 dist 9.60369 4.63732 9.66543 12.1043 10.7144 7.93372 8.78303 4.46337 8.62504 10.8635 numMergedOcc 0
14 mol 134 unq 6 iso 0 dist 9.55556 4.63732 7.21868 9.60369 5.62899 9.66543 8.78303 7.41373 8.62504 4.46337 numMergedOcc 0
15 mol 134 unq 7 iso 0 dist 9.55556 4.63732 7.21868 12.1043 5.49782 7.93372 8.78303 7.41373 8.62504 10.8635 numMergedOcc 0
16 mol 181 unq 0 iso 0 dist 9.84952 9.77747 9.01624 13.0935 11.5866 5.05973 11.2091 5.42158 9.92831 10.0773 numMergedOcc 0
17 mol 181 unq 1 iso 0 dist 7.41378 4.76079 5.05973 10.8641 11.5866 9.01624 11.1594 10.0773 9.92831 5.42158 numMergedOcc 0
18 mol 186 unq 0 iso 0 dist 8.96988 3.6848 8.90571 9.44405 7.09479 6.61112 6.26168 5.75483 8.5672 10.8286 numMergedOcc 0
19 mol 197 unq 0 iso 0 dist 8.3337 17.2264 9.10817 13.2564 5.43601 6.86828 17.1416 9.61454 6.69042 7.59871 numMergedOcc 0
20 mol 205 unq 0 iso 0 dist 8.10287 3.50446 8.4844 8.84602 10.817 7.21137 5.06713 8.90569 5.03818 4.3093 numMergedOcc 0
21 mol 205 unq 1 iso 0 dist 8.10287 3.50446 8.4844 8.84602 10.817 7.21137 8.69512 6.37317 6.40171 7.94891 numMergedOcc 0
22 mol 264 unq 0 iso 0 dist 7.36905 3.63202 5.90924 9.43335 7.07277 5.90058 9.13546 5.71153 9.78237 12.6872 numMergedOcc 0
23 mol 264 unq 1 iso 0 dist 7.36905 3.63202 5.90924 9.43335 7.07277 5.90058 10.5576 5.70542 9.70101 9.63145 numMergedOcc 0
24 mol 264 unq 2 iso 0 dist 7.36905 3.63202 5.90924 9.43335 7.07277 5.90058 8.7365 6.87635 9.95798 12.9337 numMergedOcc 0
25 mol 264 unq 3 iso 0 dist 7.36905 3.63202 5.90924 6.83408 8.96144 9.58916 9.13546 5.71153 9.78237 6.56539 numMergedOcc 0
26 mol 264 unq 4 iso 0 dist 7.36905 3.63202 5.90924 6.83408 8.96144 9.58916 10.5576 5.70542 9.70101 10.1301 numMergedOcc 0
27 mol 264 unq 5 iso 0 dist 7.36905 3.63202 5.90924 6.83408 8.96144 9.58916 8.7365 6.87635 9.95798 4.76241 numMergedOcc 0
28 mol 264 unq 6 iso 0 dist 6.83408 3.63202 9.58916 7.36905 8.96144 5.90924 9.13546 6.56539 9.78237 5.71153 numMergedOcc 0
29 mol 264 unq 7 iso 0 dist 6.83408 3.63202 9.58916 7.36905 8.96144 5.90924 10.5576 10.1301 9.70101 5.70542 numMergedOcc 0
30 mol 264 unq 8 iso 0 dist 6.83408 3.63202 9.58916 7.36905 8.96144 5.90924 8.7365 4.76241 9.95798 6.87635 numMergedOcc 0
31 mol 264 unq 9 iso 0 dist 6.83408 3.63202 9.58916 9.43335 14.3597 5.90058 9.13546 6.56539 9.78237 12.6872 numMergedOcc 0
32 mol 264 unq 10 iso 0 dist 6.83408 3.63202 9.58916 9.43335 14.3597 5.90058 10.5576 10.1301 9.70101 9.63145 numMergedOcc 0
33 mol 264 unq 11 iso 0 dist 6.83408 3.63202 9.58916 9.43335 14.3597 5.90058 8.7365 4.76241 9.95798 12.9337 numMergedOcc 0
34 mol 277 unq 0 iso 0 dist 9.77689 17.8399 9.57499 17.2403 7.69449 5.46926 20.2068 11.2997 7.16209 4.40029 numMergedOcc 0
35 mol 277 unq 1 iso 0 dist 9.77689 17.8399 9.57499 19.3912 11.8268 8.9682 20.2068 11.2997 7.16209 3.97543 numMergedOcc 0
36 mol 277 unq 2 iso 0 dist 8.51931 6.17642 9.57499 8.96343 7.69449 5.46926 10.3461 11.2997 7.16209 4.40029 numMergedOcc 0
37 mol 277 unq 3 iso 0 dist 8.51931 6.17642 9.57499 9.71491 11.8268 8.9682 10.3461 11.2997 7.16209 3.97543 numMergedOcc 0
38 mol 277 unq 4 iso 0 dist 8.96343 6.17642 5.46926 8.51931 7.69449 9.57499 10.3461 4.40029 7.16209 11.2997 numMergedOcc 0
39 mol 277 unq 5 iso 0 dist 8.96343 6.17642 5.46926 9.71491 7.08227 8.9682 10.3461 4.40029 7.16209 3.97543 numMergedOcc 0
40 mol 277 unq 6 iso 0 dist 8.96343 8.24206 5.13913 9.71491 7.08227 6.92711 10.3461 4.40029 4.62936 3.97543 numMergedOcc 0
41 mol 277 unq 7 iso 0 dist 9.29635 12.2421 8.9682 17.8158 11.8268 9.57499 11.7453 3.97543 7.16209 11.2997 numMergedOcc 0
42 mol 277 unq 8 iso 0 dist 9.29635 12.2421 8.9682 14.3464 7.08227 5.46926 11.7453 3.97543 7.16209 4.40029 numMergedOcc 0
43 mol 277 unq 9 iso 0 dist 9.29635 10.9521 6.92711 14.3464 7.08227 5.13913 11.7453 3.97543 4.62936 4.40029 numMergedOcc 0
