0 mol 12 unq 0 iso 0 dist 8.3933 6.16894 6.6051 9.3276 8.18139 11.1357 10.8052 4.86727 5.9021 11.4552 numMergedOcc 0
1 mol 12 unq 1 iso 0 dist 8.3933 6.16894 6.6051 9.3276 8.18139 11.1357 8.34132 10.763 8.98466 16.0264 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 8.65565 9.33353 4.34694 12.9035 7.47162 4.93697 17.4665 9.65371 8.4438 7.75341 numMergedOcc 0
3 mol 157 unq 0 iso 0 dist 9.20602 10.7142 6.8976 11.4584 8.9078 5.332 18.646 11.1313 9.668 9.35772 numMergedOcc 0
4 mol 158 unq 0 iso 0 dist 8.57243 11.0811 9.96635 6.32612 7.68074 7.76298 16.2207 10.9312 7.07348 12.0644 numMergedOcc 0
5 mol 158 unq 1 iso 0 dist 8.57243 11.0811 9.96635 7.80921 9.1854 8.17573 16.2207 10.9312 7.07348 13.0344 numMergedOcc 0
6 mol 186 unq 0 iso 0 dist 7.74764 6.46011 6.72718 14.2497 8.09915 13.4486 9.76509 6.12748 7.02662 13.507 numMergedOcc 0
7 mol 210 unq 0 iso 0 dist 9.30279 14.415 8.05949 5.11101 7.80421 10.8542 14.2047 7.48216 6.41444 10.0723 numMergedOcc 0
8 mol 210 unq 1 iso 0 dist 9.30279 14.415 8.05949 7.47693 9.71107 14.6074 14.2047 7.48216 6.41444 16.6086 numMergedOcc 0
9 mol 210 unq 2 iso 0 dist 9.30279 14.415 8.05949 10.5246 9.7449 13.6787 14.2047 7.48216 6.41444 16.5751 numMergedOcc 0
10 mol 266 unq 0 iso 0 dist 9.17075 13.8167 9.0836 8.86075 8.9221 7.90149 17.4898 16.492 9.77392 14.1584 numMergedOcc 0
11 mol 266 unq 1 iso 0 dist 7.68224 10.5649 9.0836 15.0292 8.9221 7.90149 16.4228 16.492 9.77392 14.1584 numMergedOcc 0
12 mol 266 unq 2 iso 0 dist 9.8751 10.5649 9.62494 15.0292 9.51145 7.90149 16.4228 18.9489 9.77392 14.1584 numMergedOcc 0
13 mol 277 unq 0 iso 0 dist 8.90911 8.3109 6.66936 12.4357 6.42951 5.38166 5.73065 5.95045 6.23539 8.18813 numMergedOcc 0
14 mol 287 unq 0 iso 0 dist 6.99084 10.4062 7.14859 4.38471 8.43856 13.8618 11.6246 8.13485 8.0935 14.152 numMergedOcc 0
15 mol 288 unq 0 iso 0 dist 6.99084 10.4062 7.14859 4.38471 8.43856 13.8618 11.6246 8.13485 8.0935 14.152 numMergedOcc 0
16 mol 289 unq 0 iso 0 dist 6.99084 10.4062 7.14859 4.38471 8.43856 13.8618 11.6246 8.13485 8.0935 14.152 numMergedOcc 0
