0 mol 90 unq 0 iso 0 dist 8.54821 7.45026 5.97902 7.4595 7.31784 9.08732 numMergedOcc 0
1 mol 141 unq 0 iso 0 dist 5.80081 5.35509 3.80087 6.27844 9.78667 8.88454 numMergedOcc 0
2 mol 141 unq 1 iso 0 dist 5.80081 5.35509 3.80087 6.2491 8.47026 9.48581 numMergedOcc 0
3 mol 141 unq 2 iso 0 dist 6.49728 5.35509 3.80763 6.27844 6.73983 8.88454 numMergedOcc 0
4 mol 141 unq 3 iso 0 dist 6.49728 5.35509 3.80763 6.2491 8.6387 9.48581 numMergedOcc 0
5 mol 156 unq 0 iso 0 dist 6.97467 6.10125 5.64188 7.94812 7.46845 5.22104 numMergedOcc 0
6 mol 182 unq 0 iso 0 dist 8.04856 7.01577 3.73864 9.14827 8.52103 8.62437 numMergedOcc 0
7 mol 204 unq 0 iso 0 dist 6.21588 7.8518 8.56684 10.2224 5.91727 12.6342 numMergedOcc 0
8 mol 237 unq 0 iso 0 dist 6.78301 5.27463 4.50383 12.2119 6.07878 8.96803 numMergedOcc 0
9 mol 253 unq 0 iso 0 dist 7.06589 8.86676 5.68255 5.37783 8.15091 6.3738 numMergedOcc 0
10 mol 256 unq 0 iso 0 dist 5.17332 3.62582 3.70808 7.73529 9.66027 8.72093 numMergedOcc 0
11 mol 256 unq 1 iso 0 dist 7.53508 7.212 4.26681 11.8833 8.89892 12.2555 numMergedOcc 0
12 mol 272 unq 0 iso 0 dist 5.9131 8.3872 6.85669 7.94696 8.13034 13.2333 numMergedOcc 0
13 mol 278 unq 0 iso 0 dist 8.60481 6.01365 10.5492 9.21229 7.21972 10.9353 numMergedOcc 0
