0 mol 4 unq 0 iso 0 dist 4.88114 6.12485 9.84838 4.70233 6.45344 10.361 6.66589 7.86036 6.56189 9.71908 numMergedOcc 0
1 mol 4 unq 1 iso 0 dist 4.88114 9.04027 7.03689 4.70233 6.45344 12.4173 6.66589 7.86036 6.22773 9.71908 numMergedOcc 0
2 mol 7 unq 0 iso 0 dist 8.14952 9.02869 8.4061 13.9246 7.7393 9.49373 5.83658 4.92824 5.37308 8.23909 numMergedOcc 0
3 mol 19 unq 0 iso 0 dist 9.3147 8.75001 10.2713 4.55916 9.65404 12.3973 11.4946 6.92576 16.2245 9.69454 numMergedOcc 0
4 mol 48 unq 0 iso 0 dist 6.01454 9.53081 5.41488 13.2371 8.96621 11.4224 14.2615 10.3987 14.4215 7.54318 numMergedOcc 0
5 mol 143 unq 0 iso 0 dist 6.68364 6.87456 7.87375 13.0852 8.99696 16.7775 16.1904 15.534 21.8332 9.61081 numMergedOcc 0
6 mol 143 unq 1 iso 0 dist 6.68364 6.87456 7.87375 13.0852 8.99696 16.7775 16.6008 13.763 21.2209 5.46922 numMergedOcc 0
7 mol 165 unq 0 iso 0 dist 8.2197 7.21397 10.5947 13.2511 5.5411 16.0639 11.88 7.59954 12.4378 9.78437 numMergedOcc 0
8 mol 220 unq 0 iso 0 dist 7.86207 9.89039 9.09963 15.8912 9.58724 18.0183 8.9077 4.90657 13.6952 7.31105 numMergedOcc 0
9 mol 220 unq 1 iso 0 dist 7.86207 8.57174 14.3078 15.8912 9.58724 19.6341 8.9077 4.90657 13.8822 7.31105 numMergedOcc 0
10 mol 220 unq 2 iso 0 dist 7.57712 5.25149 10.1832 6.555 9.58724 7.81237 15.0279 14.6296 13.3213 9.8711 numMergedOcc 0
11 mol 220 unq 3 iso 0 dist 7.57712 8.6368 13.4455 6.555 9.58724 14.9704 15.0279 14.6296 23.4423 9.8711 numMergedOcc 0
12 mol 223 unq 0 iso 0 dist 5.75896 6.97426 10.6184 6.5658 7.22882 11.4192 7.34316 5.18719 8.64175 7.82697 numMergedOcc 0
13 mol 223 unq 1 iso 0 dist 5.75896 8.87456 13.8469 6.5658 7.22882 13.9012 7.34316 5.18719 12.9895 7.82697 numMergedOcc 0
14 mol 258 unq 0 iso 0 dist 6.08181 8.10903 10.8957 9.0655 7.66806 14.766 9.67877 5.09738 13.3533 5.73296 numMergedOcc 0
15 mol 258 unq 1 iso 0 dist 6.08181 7.25618 11.0025 9.0655 7.66806 15.9916 9.67877 5.09738 15.0574 5.73296 numMergedOcc 0
16 mol 261 unq 0 iso 0 dist 6.41477 8.88741 10.1876 6.13416 9.50269 8.69675 7.15785 4.50761 6.43209 9.62828 numMergedOcc 0
17 mol 273 unq 0 iso 0 dist 8.26333 6.02879 5.40861 12.9657 7.70185 12.745 19.0038 11.2887 16.3875 7.89852 numMergedOcc 0
18 mol 273 unq 1 iso 0 dist 8.26333 6.02879 5.40861 12.6195 7.97117 11.3323 20.5685 13.4309 17.6474 8.90885 numMergedOcc 0
19 mol 273 unq 2 iso 0 dist 8.26333 6.02879 5.40861 12.6195 7.97117 11.3323 19.0038 11.2887 16.3875 9.96963 numMergedOcc 0
