0 mol 24 unq 0 iso 0 dist 6.40189 10.212 8.87744 10.6956 6.28159 7.36323 13.7733 12.3034 13.2229 8.4051 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 6.40189 10.212 8.87744 10.6956 6.28159 7.36323 4.98286 4.5711 6.38336 8.23446 numMergedOcc 0
2 mol 24 unq 2 iso 0 dist 6.40189 10.212 8.87744 10.6956 6.28159 7.36323 12.988 12.6707 6.7828 8.75662 numMergedOcc 0
3 mol 24 unq 3 iso 0 dist 5.22014 10.212 7.27472 10.6956 5.50396 7.36323 13.7733 9.84204 13.2229 8.4051 numMergedOcc 0
4 mol 24 unq 4 iso 0 dist 5.22014 10.212 7.27472 10.6956 5.50396 7.36323 4.98286 4.44526 6.38336 8.23446 numMergedOcc 0
5 mol 24 unq 5 iso 0 dist 5.22014 10.212 7.27472 10.6956 5.50396 7.36323 12.988 9.586 6.7828 8.75662 numMergedOcc 0
6 mol 25 unq 0 iso 0 dist 8.26412 8.64255 7.6114 11.2263 5.86705 6.03987 4.93307 6.29797 5.68392 6.85556 numMergedOcc 0
7 mol 58 unq 0 iso 0 dist 6.86485 7.71984 9.22598 9.74058 9.87158 6.62496 4.7391 9.01564 9.95364 8.80614 numMergedOcc 0
8 mol 58 unq 1 iso 0 dist 6.86485 4.67517 8.96727 9.74058 9.87158 6.35756 4.7391 9.01564 5.49591 8.80614 numMergedOcc 0
9 mol 58 unq 2 iso 0 dist 8.37546 4.67517 8.01308 9.74058 5.86526 6.35756 4.7391 7.11065 5.49591 8.80614 numMergedOcc 0
10 mol 58 unq 3 iso 0 dist 9.76234 12.5529 9.22598 12.818 9.87158 6.62496 4.35705 9.01564 9.95364 8.80614 numMergedOcc 0
11 mol 58 unq 4 iso 0 dist 9.76234 8.47822 8.96727 12.818 9.87158 6.35756 4.35705 9.01564 5.49591 8.80614 numMergedOcc 0
12 mol 92 unq 0 iso 0 dist 9.61144 14.8146 9.36001 9.87656 5.31547 9.64443 18.6888 12.273 13.3881 8.91313 numMergedOcc 0
13 mol 92 unq 1 iso 0 dist 9.61144 14.8146 9.36001 9.87656 5.31547 9.64443 13.9633 10.9647 5.90097 8.16392 numMergedOcc 0
14 mol 92 unq 2 iso 0 dist 6.13521 4.78289 7.06939 9.87656 4.3481 9.33898 18.6888 12.7637 17.5889 8.91313 numMergedOcc 0
15 mol 92 unq 3 iso 0 dist 6.13521 4.78289 7.06939 9.87656 4.3481 9.33898 13.9633 11.1106 10.8304 8.16392 numMergedOcc 0
16 mol 95 unq 0 iso 0 dist 9.77082 15.821 9.3948 15.8862 11.3215 8.03644 15.8604 16.0499 11.4333 9.49454 numMergedOcc 0
17 mol 95 unq 1 iso 0 dist 8.0675 9.7565 9.3948 15.5421 11.3215 8.03644 16.2905 16.0499 11.4333 9.49454 numMergedOcc 0
18 mol 98 unq 0 iso 0 dist 5.44426 9.04817 5.10496 4.31067 3.9764 5.08437 9.0917 4.62494 4.4057 6.65501 numMergedOcc 0
19 mol 98 unq 1 iso 0 dist 5.44426 4.70157 5.92242 4.31067 3.9764 6.48948 9.0917 4.62494 7.42446 6.65501 numMergedOcc 0
20 mol 98 unq 2 iso 0 dist 5.44426 6.21302 5.2571 4.31067 3.9764 6.10456 9.0917 4.62494 9.67482 6.65501 numMergedOcc 0
21 mol 98 unq 3 iso 0 dist 7.63284 4.70157 7.02507 4.31067 7.03983 6.48948 9.0917 9.84743 7.42446 6.65501 numMergedOcc 0
22 mol 98 unq 4 iso 0 dist 8.65429 9.9123 7.54889 15.6411 10.4782 6.10456 16.4829 8.46823 9.67482 6.65501 numMergedOcc 0
23 mol 100 unq 0 iso 0 dist 8.29463 5.06206 5.35782 10.4409 5.47563 7.47343 14.0144 13.2383 12.2861 8.30845 numMergedOcc 0
24 mol 100 unq 1 iso 0 dist 8.29463 5.06206 5.35782 10.4409 5.47563 7.47343 17.2226 11.4348 15.5385 8.76378 numMergedOcc 0
25 mol 133 unq 0 iso 0 dist 7.33743 6.80087 8.77023 12.8006 13.0405 6.29155 8.11294 8.83732 4.54648 6.16242 numMergedOcc 0
26 mol 133 unq 1 iso 0 dist 7.33743 6.80087 8.77023 9.73536 13.7612 6.80239 8.11294 8.83732 4.54648 5.87634 numMergedOcc 0
27 mol 134 unq 0 iso 0 dist 9.8564 12.0294 9.33094 14.18 12.3479 6.49416 8.43873 10.1824 9.87376 7.80532 numMergedOcc 0
28 mol 181 unq 0 iso 0 dist 7.83476 5.49497 6.64173 12.074 6.8757 7.81386 11.5137 12.6232 7.20191 9.39829 numMergedOcc 0
29 mol 181 unq 1 iso 0 dist 7.83476 5.49497 6.64173 9.72791 10.6474 7.63312 4.19412 8.12266 5.63555 5.9176 numMergedOcc 0
30 mol 181 unq 2 iso 0 dist 7.83476 5.49497 6.64173 9.72791 10.6474 7.63312 11.5137 12.6232 7.20191 6.41453 numMergedOcc 0
31 mol 222 unq 0 iso 0 dist 8.79662 13.3218 7.48954 16.3367 9.53117 7.21333 10.4451 8.23406 7.75656 7.67576 numMergedOcc 0
32 mol 222 unq 1 iso 0 dist 8.79662 13.3218 7.48954 16.3367 9.53117 7.21333 19.0162 14.9425 16.0949 9.82371 numMergedOcc 0
33 mol 243 unq 0 iso 0 dist 8.8602 9.51148 8.69318 8.69557 5.71505 8.23192 6.86882 11.4892 6.60697 8.76935 numMergedOcc 0
34 mol 243 unq 1 iso 0 dist 8.8602 9.51148 8.69318 8.69557 5.71505 8.23192 10.1903 11.295 4.26017 8.47652 numMergedOcc 0
35 mol 243 unq 2 iso 0 dist 7.13476 11.3833 8.69318 11.3986 5.71505 8.23192 12.8837 11.4892 6.60697 8.76935 numMergedOcc 0
36 mol 243 unq 3 iso 0 dist 7.13476 11.3833 8.69318 11.3986 5.71505 8.23192 14.3783 11.295 4.26017 8.47652 numMergedOcc 0
37 mol 243 unq 4 iso 0 dist 9.49016 6.50608 8.69318 4.89168 5.71505 8.23192 5.73931 11.4892 6.60697 8.76935 numMergedOcc 0
38 mol 243 unq 5 iso 0 dist 9.49016 6.50608 8.69318 4.89168 5.71505 8.23192 4.41191 11.295 4.26017 8.47652 numMergedOcc 0
