0 mol 26 unq 0 iso 0 dist 7.10804 14.7616 8.62527 13.0095 9.97152 9.35525 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 7.10804 14.7616 8.62527 10.5865 9.03539 10.7581 numMergedOcc 0
2 mol 26 unq 2 iso 0 dist 7.10804 14.7616 8.62527 11.4591 8.74037 7.435 numMergedOcc 0
3 mol 26 unq 3 iso 0 dist 8.64424 11.0672 8.62527 9.23049 9.97152 9.35525 numMergedOcc 0
4 mol 26 unq 4 iso 0 dist 8.64424 11.0672 8.62527 17.2516 9.03539 10.7581 numMergedOcc 0
5 mol 26 unq 5 iso 0 dist 8.64424 11.0672 8.62527 12.0994 8.74037 7.435 numMergedOcc 0
6 mol 37 unq 0 iso 0 dist 9.70445 8.42877 9.77734 15.6099 9.64602 10.1799 numMergedOcc 0
7 mol 54 unq 0 iso 0 dist 4.22514 10.5752 8.34361 6.2425 8.41365 8.98505 numMergedOcc 0
8 mol 61 unq 0 iso 0 dist 9.0081 9.35633 9.91313 9.66129 8.68888 15.8729 numMergedOcc 0
9 mol 86 unq 0 iso 0 dist 7.47462 8.02395 8.43217 6.1572 9.90016 11.6871 numMergedOcc 0
10 mol 99 unq 0 iso 0 dist 8.6659 10.8621 7.09617 4.54208 8.86001 11.0363 numMergedOcc 0
11 mol 151 unq 0 iso 0 dist 8.70668 11.2259 9.39452 11.3404 7.48309 5.32583 numMergedOcc 0
12 mol 154 unq 0 iso 0 dist 9.17333 4.05045 6.59749 6.17464 9.39643 6.28784 numMergedOcc 0
13 mol 172 unq 0 iso 0 dist 9.40213 11.0523 8.2809 8.5759 8.52605 13.7357 numMergedOcc 0
14 mol 172 unq 1 iso 0 dist 8.75042 9.39946 8.2809 14.45 8.52605 13.7357 numMergedOcc 0
15 mol 220 unq 0 iso 0 dist 7.10646 8.12353 6.64341 10.1962 8.45955 8.39567 numMergedOcc 0
16 mol 220 unq 1 iso 0 dist 7.10646 8.12353 6.64341 4.02873 7.64168 8.58398 numMergedOcc 0
17 mol 220 unq 2 iso 0 dist 7.10646 10.6332 7.31315 10.1962 8.45955 6.65038 numMergedOcc 0
18 mol 220 unq 3 iso 0 dist 7.10646 10.6332 7.31315 4.02873 7.64168 9.86325 numMergedOcc 0
19 mol 253 unq 0 iso 0 dist 9.46063 9.63143 8.11437 4.36132 6.52138 8.75798 numMergedOcc 0
20 mol 257 unq 0 iso 0 dist 8.5835 12.1004 9.27027 5.47761 7.48361 7.37187 numMergedOcc 0
21 mol 257 unq 1 iso 0 dist 8.5835 11.3116 7.87058 5.47761 7.48361 7.91645 numMergedOcc 0
22 mol 279 unq 0 iso 0 dist 5.15432 9.33832 7.35799 9.40437 8.46687 5.93805 numMergedOcc 0
23 mol 279 unq 1 iso 0 dist 8.2375 13.7765 7.35799 10.9253 8.46687 5.93805 numMergedOcc 0
24 mol 279 unq 2 iso 0 dist 9.23951 11.1553 7.35799 6.4164 8.46687 5.93805 numMergedOcc 0
