0 mol 34 unq 0 iso 0 dist 6.17472 9.48195 15.1968 5.26203 9.45239 10.8657 numMergedOcc 0
1 mol 37 unq 0 iso 0 dist 5.98359 8.5893 12.0017 4.40037 8.98454 11.9185 numMergedOcc 0
2 mol 76 unq 0 iso 0 dist 8.62536 7.75075 7.1203 10.5162 8.44819 13.6878 numMergedOcc 0
3 mol 90 unq 0 iso 0 dist 8.6308 8.96446 3.78122 8.53951 8.48639 7.62463 numMergedOcc 0
4 mol 101 unq 0 iso 0 dist 9.1109 6.54699 5.42817 10.7386 9.85715 9.33112 numMergedOcc 0
5 mol 130 unq 0 iso 0 dist 8.26291 8.12319 4.81304 12.9175 8.15289 11.8427 numMergedOcc 0
6 mol 130 unq 1 iso 0 dist 7.86001 9.04366 4.81304 6.65871 8.15289 11.8427 numMergedOcc 0
7 mol 175 unq 0 iso 0 dist 8.39634 7.19751 10.8953 8.81502 8.87876 12.1276 numMergedOcc 0
8 mol 184 unq 0 iso 0 dist 5.13722 9.511 9.62165 7.10924 9.16535 15.0761 numMergedOcc 0
9 mol 184 unq 1 iso 0 dist 5.13722 7.72354 9.27535 7.10924 9.16535 12.3849 numMergedOcc 0
10 mol 210 unq 0 iso 0 dist 7.68078 8.44451 6.36429 4.3844 8.36019 10.1018 numMergedOcc 0
11 mol 210 unq 1 iso 0 dist 7.68078 8.44451 6.36429 6.85132 7.30805 9.07117 numMergedOcc 0
12 mol 239 unq 0 iso 0 dist 4.21935 7.99963 7.72768 8.15025 7.69491 10.5638 numMergedOcc 0
13 mol 249 unq 0 iso 0 dist 6.04688 5.7671 7.19269 6.46947 9.1515 11.0585 numMergedOcc 0
14 mol 252 unq 0 iso 0 dist 8.04265 7.54349 6.40957 7.44658 4.54745 7.62991 numMergedOcc 0
15 mol 252 unq 1 iso 0 dist 9.42193 7.38867 8.56684 8.846 4.54745 9.81261 numMergedOcc 0
16 mol 269 unq 0 iso 0 dist 9.91093 7.79735 4.41005 11.5175 7.92043 11.0007 numMergedOcc 0
17 mol 283 unq 0 iso 0 dist 6.15136 9.33601 11.413 5.83652 5.05882 11.5443 numMergedOcc 0
18 mol 287 unq 0 iso 0 dist 8.83885 9.57637 7.24849 8.58414 9.94851 4.93516 numMergedOcc 0
19 mol 288 unq 0 iso 0 dist 8.83885 9.57637 7.24849 8.58414 9.94851 4.93516 numMergedOcc 0
20 mol 289 unq 0 iso 0 dist 8.83885 9.57637 7.24849 8.58414 9.94851 4.93516 numMergedOcc 0
