0 mol 34 unq 0 iso 0 dist 4.97286 6.00825 4.50643 7.16404 7.78892 4.30086 numMergedOcc 0
1 mol 46 unq 0 iso 0 dist 9.37127 10.2246 9.52298 6.124 9.86627 6.59405 numMergedOcc 0
2 mol 68 unq 0 iso 0 dist 8.87326 8.24627 5.48997 4.46345 9.40333 9.32604 numMergedOcc 0
3 mol 68 unq 1 iso 0 dist 5.99047 9.16318 5.48997 5.53078 9.40333 9.32604 numMergedOcc 0
4 mol 73 unq 0 iso 0 dist 8.70465 8.54022 6.85356 14.9119 6.3777 10.539 numMergedOcc 0
5 mol 73 unq 1 iso 0 dist 8.70465 15.6804 7.32265 14.9119 6.3777 4.91508 numMergedOcc 0
6 mol 110 unq 0 iso 0 dist 7.85994 10.8513 9.00302 8.73402 7.32156 4.98189 numMergedOcc 0
7 mol 133 unq 0 iso 0 dist 8.58727 7.22293 5.92836 14.0905 9.47554 14.5299 numMergedOcc 0
8 mol 156 unq 0 iso 0 dist 8.95171 13.2289 5.50879 11.1222 8.50926 10.9993 numMergedOcc 0
9 mol 156 unq 1 iso 0 dist 8.95171 6.91184 6.69157 11.1222 8.50926 4.75264 numMergedOcc 0
10 mol 158 unq 0 iso 0 dist 8.57243 12.5458 8.95432 12.3624 9.99005 3.8949 numMergedOcc 0
11 mol 172 unq 0 iso 0 dist 6.10845 10.5641 9.21942 7.39386 8.84981 9.90132 numMergedOcc 0
12 mol 172 unq 1 iso 0 dist 6.16303 6.78233 7.77643 11.3253 9.18538 5.78278 numMergedOcc 0
13 mol 172 unq 2 iso 0 dist 6.16303 8.65462 4.90175 11.3253 9.18538 5.25252 numMergedOcc 0
14 mol 209 unq 0 iso 0 dist 8.9906 13.8836 8.8886 5.35615 9.62543 11.2558 numMergedOcc 0
15 mol 209 unq 1 iso 0 dist 8.9906 15.5731 8.78565 5.35615 9.62543 12.9345 numMergedOcc 0
16 mol 209 unq 2 iso 0 dist 9.9897 6.62558 6.82209 5.64285 9.66809 5.3114 numMergedOcc 0
17 mol 217 unq 0 iso 0 dist 8.04881 6.21857 7.95365 12.2559 6.23025 10.8814 numMergedOcc 0
18 mol 271 unq 0 iso 0 dist 6.56531 5.22029 5.76281 6.00331 9.42899 5.31774 numMergedOcc 0
19 mol 280 unq 0 iso 0 dist 8.45851 11.5456 6.38295 4.56991 5.41639 8.30978 numMergedOcc 0
20 mol 280 unq 1 iso 0 dist 8.45851 11.5456 6.38295 8.69519 7.96485 5.80223 numMergedOcc 0
