0 mol 20 unq 0 iso 0 dist 5.88082 8.46939 8.65986 13.7278 9.33614 8.93826 numMergedOcc 0
1 mol 20 unq 1 iso 0 dist 5.88082 8.46939 8.65986 10.7111 6.48654 7.17695 numMergedOcc 0
2 mol 20 unq 2 iso 0 dist 5.88082 7.27778 9.39462 10.7111 6.48654 9.33207 numMergedOcc 0
3 mol 20 unq 3 iso 0 dist 5.35469 8.46939 9.74724 13.7278 12.0458 8.93826 numMergedOcc 0
4 mol 20 unq 4 iso 0 dist 5.35469 8.46939 9.74724 10.7111 8.39164 7.17695 numMergedOcc 0
5 mol 20 unq 5 iso 0 dist 5.35469 7.27778 9.13347 10.7111 8.39164 9.33207 numMergedOcc 0
6 mol 20 unq 6 iso 0 dist 8.93872 12.0473 9.84488 11.9747 7.69558 7.6974 numMergedOcc 0
7 mol 20 unq 7 iso 0 dist 5.31029 6.07019 7.68245 6.87567 3.62557 6.69651 numMergedOcc 0
8 mol 20 unq 8 iso 0 dist 8.34499 6.07019 9.55686 6.87567 9.05929 6.69651 numMergedOcc 0
9 mol 78 unq 0 iso 0 dist 6.88471 9.49441 9.86479 14.9523 14.9274 6.73466 numMergedOcc 0
10 mol 78 unq 1 iso 0 dist 7.74797 15.7569 9.86479 21.8593 14.9274 6.73466 numMergedOcc 0
11 mol 78 unq 2 iso 0 dist 8.19547 5.15922 9.86479 11.5898 14.9274 6.73466 numMergedOcc 0
12 mol 81 unq 0 iso 0 dist 5.9013 3.71214 5.2168 9.1024 8.74391 9.53663 numMergedOcc 0
13 mol 90 unq 0 iso 0 dist 7.10895 8.91067 9.33968 10.0495 5.69354 6.10053 numMergedOcc 0
14 mol 148 unq 0 iso 0 dist 9.62458 6.53248 8.88297 8.6499 3.78181 6.81449 numMergedOcc 0
15 mol 150 unq 0 iso 0 dist 9.64273 6.52303 8.82984 8.75339 3.72958 6.87593 numMergedOcc 0
16 mol 176 unq 0 iso 0 dist 8.8556 7.95619 5.60333 9.37772 4.57491 8.51811 numMergedOcc 0
17 mol 176 unq 1 iso 0 dist 8.8556 4.99447 5.58647 9.37772 4.57491 7.26558 numMergedOcc 0
18 mol 254 unq 0 iso 0 dist 8.39401 10.459 6.56151 17.467 9.71492 9.09568 numMergedOcc 0
19 mol 254 unq 1 iso 0 dist 8.39401 10.459 6.56151 11.968 3.58476 7.84221 numMergedOcc 0
20 mol 254 unq 2 iso 0 dist 8.39401 11.1049 8.3417 17.467 9.71492 9.99168 numMergedOcc 0
21 mol 254 unq 3 iso 0 dist 8.39401 11.1049 8.3417 11.968 3.58476 9.67383 numMergedOcc 0
22 mol 277 unq 0 iso 0 dist 9.32681 7.03845 6.12608 13.5703 13.6282 8.24013 numMergedOcc 0
23 mol 283 unq 0 iso 0 dist 5.34771 5.91899 9.74797 5.33054 3.27256 9.35302 numMergedOcc 0
24 mol 283 unq 1 iso 0 dist 5.34771 8.2722 9.90494 5.33054 3.27256 8.85163 numMergedOcc 0
25 mol 283 unq 2 iso 0 dist 9.2825 8.2722 5.90121 5.33054 10.2725 8.85163 numMergedOcc 0
26 mol 283 unq 3 iso 0 dist 9.40332 8.32685 9.74797 8.56376 3.27256 9.35302 numMergedOcc 0
27 mol 283 unq 4 iso 0 dist 9.40332 5.93642 9.90494 8.56376 3.27256 8.85163 numMergedOcc 0
28 mol 283 unq 5 iso 0 dist 5.8676 5.93642 5.90121 8.56376 10.2725 8.85163 numMergedOcc 0
29 mol 286 unq 0 iso 0 dist 6.57496 8.51361 6.87255 7.6123 6.41589 8.87916 numMergedOcc 0
30 mol 286 unq 1 iso 0 dist 7.9554 10.1725 6.87255 11.1421 6.41589 8.87916 numMergedOcc 0
