0 mol 30 unq 0 iso 0 dist 8.64082 8.609 7.18789 4.64354 10.5288 6.83481 10.7721 10.4798 6.95343 8.50298 numMergedOcc 0
1 mol 30 unq 1 iso 0 dist 7.2159 5.5814 5.39896 6.57228 9.77521 7.47342 10.5283 11.4581 7.27268 6.94189 numMergedOcc 0
2 mol 30 unq 2 iso 0 dist 8.93093 5.5814 8.16648 6.57228 14.5174 7.47342 10.5283 14.8457 7.27268 6.94189 numMergedOcc 0
3 mol 51 unq 0 iso 0 dist 6.50216 7.12423 5.27155 12.224 12.263 9.23497 4.00441 8.94858 7.52921 9.50403 numMergedOcc 0
4 mol 51 unq 1 iso 0 dist 9.83073 7.12423 14.6972 12.224 21.606 9.23497 4.00441 13.6719 7.52921 9.50403 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 5.58346 6.18305 5.2774 12.2435 7.84699 8.124 12.2635 12.6162 9.79143 16.278 numMergedOcc 0
6 mol 73 unq 1 iso 0 dist 9.10386 6.18305 5.44275 12.2435 8.40844 8.124 12.2635 8.91833 9.79143 16.278 numMergedOcc 0
7 mol 86 unq 0 iso 0 dist 7.91639 8.88225 10.9597 11.0165 16.2055 8.40609 12.2577 15.8499 6.81209 11.4177 numMergedOcc 0
8 mol 110 unq 0 iso 0 dist 5.43052 8.181 9.01856 10.0455 13.516 9.89881 4.6178 4.9088 8.76445 14.0959 numMergedOcc 0
9 mol 119 unq 0 iso 0 dist 9.44788 5.63005 12.1168 11.5865 18.7603 8.62648 5.4578 8.82502 6.69217 10.2909 numMergedOcc 0
10 mol 219 unq 0 iso 0 dist 9.52151 4.87446 10.9246 6.28221 7.98941 6.8424 5.53139 9.59958 8.69579 10.7226 numMergedOcc 0
11 mol 219 unq 1 iso 0 dist 8.62654 4.87446 10.1098 6.28221 14.8072 6.8424 5.53139 7.44159 8.69579 10.7226 numMergedOcc 0
12 mol 252 unq 0 iso 0 dist 8.63848 6.1197 4.98533 9.75362 7.74647 6.41821 4.59117 9.53444 6.68262 6.80158 numMergedOcc 0
13 mol 256 unq 0 iso 0 dist 9.37687 7.67598 9.07441 4.19031 8.11884 5.98967 11.6106 6.5266 9.72168 8.0817 numMergedOcc 0
14 mol 258 unq 0 iso 0 dist 9.4886 5.73834 8.31011 5.59455 14.9146 8.9706 5.71858 11.0425 8.14531 7.32623 numMergedOcc 0
