0 mol 4 unq 0 iso 0 dist 4.88114 6.12485 9.84838 6.66589 7.86036 6.56189 4.70233 6.45344 10.361 9.71908 numMergedOcc 0
1 mol 4 unq 1 iso 0 dist 4.88114 9.04027 7.03689 6.66589 7.86036 6.22773 4.70233 6.45344 12.4173 9.71908 numMergedOcc 0
2 mol 7 unq 0 iso 0 dist 8.41173 7.38748 10.1841 6.22892 6.3027 5.0893 4.30113 9.76779 11.6762 9.64738 numMergedOcc 0
3 mol 7 unq 1 iso 0 dist 8.14952 9.02869 8.4061 5.83658 4.92824 5.37308 13.9246 7.7393 9.49373 8.23909 numMergedOcc 0
4 mol 8 unq 0 iso 0 dist 9.00925 8.68949 16.2669 8.89145 5.7343 13.2274 4.36784 9.66021 12.3971 11.6352 numMergedOcc 0
5 mol 8 unq 1 iso 0 dist 9.00925 8.68949 16.2669 6.92865 11.3728 8.33226 4.36784 9.66021 12.3971 9.97264 numMergedOcc 0
6 mol 19 unq 0 iso 0 dist 9.3147 8.75001 10.2713 7.78708 9.38012 5.18509 4.55916 9.65404 12.3973 11.8366 numMergedOcc 0
7 mol 19 unq 1 iso 0 dist 9.3147 8.75001 10.2713 7.84393 10.5285 12.48 4.55916 9.65404 12.3973 10.1088 numMergedOcc 0
8 mol 48 unq 0 iso 0 dist 6.01454 9.53081 5.41488 5.36645 9.26483 12.299 13.2371 8.96621 11.4224 17.3953 numMergedOcc 0
9 mol 143 unq 0 iso 0 dist 6.68364 6.87456 7.87375 5.30872 5.4432 8.03483 13.0852 8.99696 16.7775 11.3921 numMergedOcc 0
10 mol 186 unq 0 iso 0 dist 9.94142 8.46819 8.05438 8.93307 11.5966 4.37376 12.085 8.51847 12.1501 16.0612 numMergedOcc 0
11 mol 220 unq 0 iso 0 dist 7.86207 9.89039 9.09963 8.9077 4.90657 13.6952 15.8912 9.58724 18.0183 7.31105 numMergedOcc 0
12 mol 220 unq 1 iso 0 dist 7.86207 8.57174 14.3078 8.9077 4.90657 13.8822 15.8912 9.58724 19.6341 7.31105 numMergedOcc 0
13 mol 223 unq 0 iso 0 dist 5.75896 6.97426 10.6184 9.94212 7.19485 15.9255 6.5658 7.22882 11.4192 12.0329 numMergedOcc 0
14 mol 223 unq 1 iso 0 dist 5.75896 6.97426 10.6184 7.34316 5.18719 8.64175 6.5658 7.22882 11.4192 7.82697 numMergedOcc 0
15 mol 223 unq 2 iso 0 dist 5.75896 8.87456 13.8469 9.94212 7.19485 17.7343 6.5658 7.22882 13.9012 12.0329 numMergedOcc 0
16 mol 223 unq 3 iso 0 dist 5.75896 8.87456 13.8469 7.34316 5.18719 12.9895 6.5658 7.22882 13.9012 7.82697 numMergedOcc 0
17 mol 258 unq 0 iso 0 dist 6.08181 8.10903 10.8957 9.67877 5.09738 13.3533 9.0655 7.66806 14.766 5.73296 numMergedOcc 0
18 mol 258 unq 1 iso 0 dist 6.08181 8.10903 10.8957 8.81059 13.8694 5.90131 9.0655 7.66806 14.766 17.0459 numMergedOcc 0
19 mol 258 unq 2 iso 0 dist 6.08181 8.10903 10.8957 9.12006 14.0402 9.68064 9.0655 7.66806 14.766 18.0882 numMergedOcc 0
20 mol 258 unq 3 iso 0 dist 6.08181 7.25618 11.0025 9.67877 5.09738 15.0574 9.0655 7.66806 15.9916 5.73296 numMergedOcc 0
21 mol 258 unq 4 iso 0 dist 6.08181 7.25618 11.0025 8.81059 13.8694 4.51422 9.0655 7.66806 15.9916 17.0459 numMergedOcc 0
22 mol 258 unq 5 iso 0 dist 6.08181 7.25618 11.0025 9.12006 14.0402 4.99997 9.0655 7.66806 15.9916 18.0882 numMergedOcc 0
23 mol 261 unq 0 iso 0 dist 6.41477 8.88741 10.1876 7.15785 4.50761 6.43209 6.13416 9.50269 8.69675 9.62828 numMergedOcc 0
24 mol 261 unq 1 iso 0 dist 6.41477 8.88741 10.1876 9.43169 8.80293 7.78464 6.13416 9.50269 8.69675 13.3636 numMergedOcc 0
