0 mol 14 unq 0 iso 0 dist 7.66311 8.91266 7.00835 7.64253 7.87063 11.8971 numMergedOcc 0
1 mol 14 unq 1 iso 0 dist 7.66311 8.91266 7.00835 5.64247 5.93401 10.5825 numMergedOcc 0
2 mol 30 unq 0 iso 0 dist 7.83595 8.37503 6.40527 5.33828 9.07692 6.95343 numMergedOcc 0
3 mol 48 unq 0 iso 0 dist 6.01454 5.36645 9.26483 9.26625 8.07681 13.8672 numMergedOcc 0
4 mol 54 unq 0 iso 0 dist 7.00677 6.09782 5.29727 5.55066 9.81224 5.63261 numMergedOcc 0
5 mol 64 unq 0 iso 0 dist 9.3473 9.10915 9.82646 12.7258 6.53573 16.162 numMergedOcc 0
6 mol 64 unq 1 iso 0 dist 9.3473 7.02352 9.96083 12.7258 6.53573 13.9338 numMergedOcc 0
7 mol 64 unq 2 iso 0 dist 8.14932 8.66921 9.82646 12.0922 6.53573 16.162 numMergedOcc 0
8 mol 73 unq 0 iso 0 dist 9.27355 4.24428 9.76331 15.9568 8.91833 15.1135 numMergedOcc 0
9 mol 73 unq 1 iso 0 dist 9.27355 6.30194 5.44275 15.9568 8.91833 9.79143 numMergedOcc 0
10 mol 88 unq 0 iso 0 dist 9.64551 9.25163 8.44462 9.11346 8.95194 10.0313 numMergedOcc 0
11 mol 133 unq 0 iso 0 dist 9.6582 5.97805 12.6081 11.3115 6.98375 14.045 numMergedOcc 0
12 mol 133 unq 1 iso 0 dist 5.17734 5.97805 5.26273 11.3115 8.8405 14.045 numMergedOcc 0
13 mol 133 unq 2 iso 0 dist 5.17734 5.97805 5.26273 5.49451 5.80662 6.05583 numMergedOcc 0
14 mol 206 unq 0 iso 0 dist 8.93927 5.79186 11.2111 6.16807 8.13196 6.20349 numMergedOcc 0
15 mol 230 unq 0 iso 0 dist 6.88683 8.33847 6.87235 6.02175 7.63624 5.31963 numMergedOcc 0
16 mol 230 unq 1 iso 0 dist 7.43793 9.12305 6.87235 4.76236 7.63624 5.31963 numMergedOcc 0
17 mol 230 unq 2 iso 0 dist 7.43793 9.30906 5.4427 4.76236 7.63624 7.85632 numMergedOcc 0
18 mol 230 unq 3 iso 0 dist 8.4739 9.12305 9.94041 4.76236 9.95611 5.31963 numMergedOcc 0
19 mol 230 unq 4 iso 0 dist 8.4739 9.30906 5.52842 4.76236 9.95611 7.85632 numMergedOcc 0
20 mol 280 unq 0 iso 0 dist 7.02503 8.40961 8.10688 4.15721 5.57971 9.87367 numMergedOcc 0
21 mol 280 unq 1 iso 0 dist 9.18164 9.42213 8.10688 9.84171 5.57971 9.87367 numMergedOcc 0
