0 mol 0 unq 0 iso 0 dist 9.5614 7.79534 9.46298 9.40697 6.94181 12.2644 18.3338 14.0556 21.928 9.94618 numMergedOcc 0
1 mol 16 unq 0 iso 0 dist 9.04834 5.36911 6.51133 9.19152 6.28033 9.9153 14.0448 5.59769 12.1062 7.72142 numMergedOcc 0
2 mol 30 unq 0 iso 0 dist 8.37503 8.90581 4.94076 6.78528 6.83481 10.7302 7.83595 6.40527 5.02236 9.72314 numMergedOcc 0
3 mol 124 unq 0 iso 0 dist 7.23052 9.18949 14.8831 9.2094 6.35314 16.8959 10.619 5.31501 16.7174 5.61764 numMergedOcc 0
4 mol 140 unq 0 iso 0 dist 9.41832 6.58859 11.9251 12.2179 9.68229 17.8072 21.5261 16.7631 26.3766 9.74209 numMergedOcc 0
5 mol 220 unq 0 iso 0 dist 8.9077 7.46122 7.11498 11.9931 6.21273 7.58118 7.86207 4.90657 4.39102 8.58709 numMergedOcc 0
6 mol 230 unq 0 iso 0 dist 8.33847 8.85051 5.0515 11.8106 5.62804 10.5172 13.8632 7.07028 10.3005 5.00735 numMergedOcc 0
7 mol 230 unq 1 iso 0 dist 8.33847 8.85051 5.0515 11.8106 5.62804 10.5172 13.4503 5.26217 7.15627 6.73755 numMergedOcc 0
8 mol 239 unq 0 iso 0 dist 9.27989 6.91534 11.169 9.44182 6.83046 10.3846 10.2234 5.29737 13.0625 4.21935 numMergedOcc 0
9 mol 239 unq 1 iso 0 dist 9.27989 8.67704 14.8007 9.44182 6.83046 15.4193 10.2234 5.29737 17.3981 4.21935 numMergedOcc 0
10 mol 256 unq 0 iso 0 dist 8.43264 7.54955 5.28793 7.68659 5.98967 9.94144 14.8948 9.07441 14.0638 8.11884 numMergedOcc 0
11 mol 274 unq 0 iso 0 dist 8.3291 9.35929 6.11414 9.34663 8.78883 10.809 13.5853 8.19222 7.12906 8.99974 numMergedOcc 0
12 mol 274 unq 1 iso 0 dist 8.3291 9.35929 6.11414 9.34663 8.78883 10.809 8.75703 4.97216 5.43792 5.68643 numMergedOcc 0
13 mol 274 unq 2 iso 0 dist 8.3291 9.35929 6.11414 9.34663 8.78883 10.809 10.0237 10.2686 6.81974 8.36043 numMergedOcc 0
14 mol 279 unq 0 iso 0 dist 6.47376 9.29922 12.6502 4.77763 8.68797 5.21664 5.78017 5.34376 13.4771 8.36655 numMergedOcc 0
