0 mol 12 unq 0 iso 0 dist 8.3933 4.46781 9.75368 4.85969 4.60834 7.8865 numMergedOcc 0
1 mol 34 unq 0 iso 0 dist 4.97286 7.16404 7.78892 9.12062 5.70643 7.10899 numMergedOcc 0
2 mol 46 unq 0 iso 0 dist 9.37127 6.124 9.86627 6.46901 4.5746 9.77553 numMergedOcc 0
3 mol 69 unq 0 iso 0 dist 8.23686 9.59206 7.25721 11.0493 4.2124 5.47319 numMergedOcc 0
4 mol 110 unq 0 iso 0 dist 7.85994 8.73402 7.32156 10.4529 4.37836 7.09405 numMergedOcc 0
5 mol 133 unq 0 iso 0 dist 8.58727 14.0905 9.47554 12.5406 4.98521 5.86531 numMergedOcc 0
6 mol 134 unq 0 iso 0 dist 9.66592 4.83963 9.16358 12.7799 5.73962 9.92932 numMergedOcc 0
7 mol 134 unq 1 iso 0 dist 9.66592 4.83963 9.16358 13.9823 10.971 9.55556 numMergedOcc 0
8 mol 134 unq 2 iso 0 dist 9.66592 5.21119 6.48328 12.7799 5.73962 9.60411 numMergedOcc 0
9 mol 171 unq 0 iso 0 dist 8.31358 6.71379 7.73971 9.53702 4.78402 6.07091 numMergedOcc 0
10 mol 173 unq 0 iso 0 dist 7.76428 7.11247 9.80037 6.46871 5.07225 8.1088 numMergedOcc 0
11 mol 226 unq 0 iso 0 dist 9.45587 11.9892 5.90092 12.2727 4.00573 7.117 numMergedOcc 0
12 mol 229 unq 0 iso 0 dist 7.06416 5.23042 9.40032 4.38586 3.99138 7.10634 numMergedOcc 0
13 mol 236 unq 0 iso 0 dist 8.74211 8.93012 6.61371 6.79115 4.93347 9.89665 numMergedOcc 0
14 mol 249 unq 0 iso 0 dist 5.36183 4.24754 6.26142 9.35597 7.08836 6.37672 numMergedOcc 0
15 mol 249 unq 1 iso 0 dist 5.36183 4.24754 6.26142 12.3774 9.91022 8.94023 numMergedOcc 0
16 mol 261 unq 0 iso 0 dist 7.43425 6.39263 7.00833 8.07113 5.96176 9.73983 numMergedOcc 0
17 mol 271 unq 0 iso 0 dist 6.56531 6.00331 9.42899 9.27556 5.60228 9.56149 numMergedOcc 0
18 mol 277 unq 0 iso 0 dist 8.90911 11.9195 4.81916 20.5918 12.5633 9.29635 numMergedOcc 0
