0 mol 7 unq 0 iso 0 dist 5.51421 6.769 6.8464 4.7739 5.99459 4.65291 numMergedOcc 0
1 mol 64 unq 0 iso 0 dist 8.99491 4.69203 8.75668 9.07673 9.86334 11.5793 numMergedOcc 0
2 mol 68 unq 0 iso 0 dist 8.04256 4.85985 7.89424 7.21365 7.39665 3.89663 numMergedOcc 0
3 mol 68 unq 1 iso 0 dist 7.51075 9.89879 7.89424 6.56256 7.39665 3.89663 numMergedOcc 0
4 mol 69 unq 0 iso 0 dist 5.47319 4.2124 7.25721 4.69809 5.99857 3.77519 numMergedOcc 0
5 mol 76 unq 0 iso 0 dist 8.58841 4.81317 8.77218 16.3337 9.85905 14.6511 numMergedOcc 0
6 mol 76 unq 1 iso 0 dist 8.09199 4.16711 5.91259 5.37642 9.13322 4.2488 numMergedOcc 0
7 mol 76 unq 2 iso 0 dist 7.47794 9.76087 5.91259 12.1618 9.13322 4.2488 numMergedOcc 0
8 mol 81 unq 0 iso 0 dist 9.08307 4.57548 9.48146 3.71228 7.07095 3.82386 numMergedOcc 0
9 mol 85 unq 0 iso 0 dist 6.58793 11.4201 9.67557 6.97936 7.7068 11.3963 numMergedOcc 0
10 mol 95 unq 0 iso 0 dist 9.65047 16.8321 9.64673 8.55456 9.3948 10.6733 numMergedOcc 0
11 mol 95 unq 1 iso 0 dist 9.65047 16.8321 9.64673 3.84879 9.74607 15.954 numMergedOcc 0
12 mol 109 unq 0 iso 0 dist 8.3164 12.6973 9.41191 8.08642 7.07971 9.45977 numMergedOcc 0
13 mol 110 unq 0 iso 0 dist 7.09405 4.37836 7.32156 7.7492 8.49678 5.2677 numMergedOcc 0
14 mol 122 unq 0 iso 0 dist 6.78949 4.24711 8.75778 4.78332 6.00603 4.06619 numMergedOcc 0
15 mol 122 unq 1 iso 0 dist 9.40018 13.7131 8.75778 12.4857 6.00603 4.06619 numMergedOcc 0
16 mol 129 unq 0 iso 0 dist 9.28278 4.74644 8.00624 9.05571 5.51197 6.31483 numMergedOcc 0
17 mol 129 unq 1 iso 0 dist 9.28278 4.74644 8.00624 9.63308 6.69691 9.82512 numMergedOcc 0
18 mol 129 unq 2 iso 0 dist 9.28278 4.74644 8.00624 14.5546 8.86944 14.6258 numMergedOcc 0
19 mol 134 unq 0 iso 0 dist 9.92932 5.73962 9.16358 3.76211 7.21868 7.07082 numMergedOcc 0
20 mol 134 unq 1 iso 0 dist 9.60411 5.73962 6.48328 11.6349 9.33924 9.80637 numMergedOcc 0
21 mol 134 unq 2 iso 0 dist 9.60411 5.73962 6.48328 3.76211 7.93372 7.07082 numMergedOcc 0
22 mol 134 unq 3 iso 0 dist 9.55556 10.971 9.16358 4.63732 7.21868 7.07082 numMergedOcc 0
23 mol 154 unq 0 iso 0 dist 6.23399 3.82471 6.36439 5.18463 8.33439 7.59527 numMergedOcc 0
24 mol 180 unq 0 iso 0 dist 7.1027 3.90063 7.71517 3.81673 8.82325 5.66123 numMergedOcc 0
25 mol 181 unq 0 iso 0 dist 7.41378 4.44971 9.4775 4.76079 5.05973 6.27015 numMergedOcc 0
26 mol 181 unq 1 iso 0 dist 7.41378 4.82806 4.71906 4.76079 5.05973 3.97523 numMergedOcc 0
27 mol 197 unq 0 iso 0 dist 8.3337 14.6381 8.67786 17.2264 9.10817 6.57766 numMergedOcc 0
28 mol 197 unq 1 iso 0 dist 8.3337 14.6381 8.67786 5.5875 9.73548 12.3362 numMergedOcc 0
29 mol 205 unq 0 iso 0 dist 5.96555 4.12904 8.52924 6.96644 6.52816 10.3649 numMergedOcc 0
30 mol 214 unq 0 iso 0 dist 9.51764 8.79059 9.92165 14.8375 7.46481 14.5969 numMergedOcc 0
31 mol 214 unq 1 iso 0 dist 5.36829 10.6379 9.92165 5.47184 7.46481 14.5969 numMergedOcc 0
32 mol 277 unq 0 iso 0 dist 9.29635 12.5633 4.81916 12.7269 9.35539 9.31926 numMergedOcc 0
33 mol 277 unq 1 iso 0 dist 9.29635 12.5633 4.81916 12.2421 8.9682 13.1828 numMergedOcc 0
34 mol 277 unq 2 iso 0 dist 9.29635 12.5633 4.81916 10.9521 6.92711 10.6994 numMergedOcc 0
