0 mol 4 unq 0 iso 0 dist 6.12485 6.66589 6.56189 4.70233 10.361 9.71908 11.913 17.7416 14.3678 8.57798 numMergedOcc 0
1 mol 4 unq 1 iso 0 dist 6.12485 6.66589 6.56189 4.70233 10.361 9.71908 4.88114 9.84838 7.86036 6.45344 numMergedOcc 0
2 mol 4 unq 2 iso 0 dist 6.86951 9.80478 6.56189 7.10738 10.361 9.71908 15.4904 17.7416 14.3678 8.57798 numMergedOcc 0
3 mol 4 unq 3 iso 0 dist 6.86951 9.80478 6.56189 7.10738 10.361 9.71908 10.9924 9.84838 7.86036 6.45344 numMergedOcc 0
4 mol 4 unq 4 iso 0 dist 9.04027 6.66589 6.22773 4.70233 12.4173 9.71908 11.913 15.0688 14.3678 8.57798 numMergedOcc 0
5 mol 4 unq 5 iso 0 dist 9.04027 6.66589 6.22773 4.70233 12.4173 9.71908 4.88114 7.03689 7.86036 6.45344 numMergedOcc 0
6 mol 7 unq 0 iso 0 dist 9.02869 5.83658 5.37308 13.9246 9.49373 8.23909 8.14952 8.4061 4.92824 7.7393 numMergedOcc 0
7 mol 212 unq 0 iso 0 dist 6.36102 7.3529 4.06334 6.9794 10.7192 9.53824 13.6797 12.9526 10.7641 9.12948 numMergedOcc 0
8 mol 214 unq 0 iso 0 dist 7.82201 9.40003 17.1162 10.6403 16.0716 8.49704 16.7045 22.1896 13.0236 9.03521 numMergedOcc 0
9 mol 220 unq 0 iso 0 dist 9.89039 8.9077 13.6952 15.8912 18.0183 7.31105 7.86207 9.09963 4.90657 9.58724 numMergedOcc 0
10 mol 220 unq 1 iso 0 dist 8.57174 8.9077 13.8822 15.8912 19.6341 7.31105 7.86207 14.3078 4.90657 9.58724 numMergedOcc 0
11 mol 223 unq 0 iso 0 dist 6.97426 7.34316 8.64175 6.5658 11.4192 7.82697 5.75896 10.6184 5.18719 7.22882 numMergedOcc 0
12 mol 223 unq 1 iso 0 dist 8.87456 7.34316 12.9895 6.5658 13.9012 7.82697 5.75896 13.8469 5.18719 7.22882 numMergedOcc 0
13 mol 236 unq 0 iso 0 dist 4.71683 6.73134 7.41812 10.1358 13.6596 8.77254 12.3547 16.0498 10.6351 7.34709 numMergedOcc 0
14 mol 258 unq 0 iso 0 dist 8.10903 9.67877 13.3533 9.0655 14.766 5.73296 6.08181 10.8957 5.09738 7.66806 numMergedOcc 0
15 mol 258 unq 1 iso 0 dist 7.25618 9.67877 15.0574 9.0655 15.9916 5.73296 6.08181 11.0025 5.09738 7.66806 numMergedOcc 0
16 mol 261 unq 0 iso 0 dist 8.88741 7.15785 6.43209 6.13416 8.69675 9.62828 6.41477 10.1876 4.50761 9.50269 numMergedOcc 0
17 mol 273 unq 0 iso 0 dist 5.78262 6.54753 4.77695 4.62586 9.57582 8.90885 11.5085 16.1628 13.4309 7.97117 numMergedOcc 0
18 mol 273 unq 1 iso 0 dist 7.6489 6.54753 9.01117 4.62586 11.4985 8.90885 11.5085 15.5515 13.4309 7.97117 numMergedOcc 0
