0 mol 7 unq 0 iso 0 dist 7.38748 6.22892 5.0893 7.15287 6.8464 8.41585 14.4257 10.1033 13.5229 7.78327 numMergedOcc 0
1 mol 73 unq 0 iso 0 dist 8.90896 5.79954 4.78435 14.1415 10.2786 9.38498 10.3601 4.40015 4.73407 6.23522 numMergedOcc 0
2 mol 76 unq 0 iso 0 dist 7.48127 4.83274 10.6009 10.2219 14.6364 6.97941 5.91098 8.58474 3.69293 7.61521 numMergedOcc 0
3 mol 127 unq 0 iso 0 dist 5.83719 6.65963 4.98711 10.345 11.2815 8.14887 14.5617 13.509 10.2024 5.39356 numMergedOcc 0
4 mol 127 unq 1 iso 0 dist 5.83719 6.65963 4.98711 10.345 11.2815 8.14887 9.15924 4.41923 5.4328 9.92746 numMergedOcc 0
5 mol 127 unq 2 iso 0 dist 5.83719 8.62711 11.2447 10.345 11.2815 9.30299 14.5617 13.509 12.7606 5.39356 numMergedOcc 0
6 mol 127 unq 3 iso 0 dist 5.83719 8.62711 11.2447 10.345 11.2815 9.30299 9.15924 4.41923 12.6193 9.92746 numMergedOcc 0
7 mol 143 unq 0 iso 0 dist 6.87456 5.30872 8.03483 6.3915 12.5106 5.99315 9.9753 12.6167 9.14188 8.99891 numMergedOcc 0
8 mol 143 unq 1 iso 0 dist 5.40826 7.5984 9.02772 5.11989 9.35213 5.99315 5.33772 3.66518 6.75249 8.64905 numMergedOcc 0
9 mol 181 unq 0 iso 0 dist 8.92801 9.63295 9.40823 12.5935 12.8027 7.63312 17.8667 13.9827 13.2274 8.29467 numMergedOcc 0
10 mol 181 unq 1 iso 0 dist 9.40718 9.63295 5.32364 12.5935 11.9989 7.63312 17.8667 18.4844 13.2274 8.29467 numMergedOcc 0
11 mol 214 unq 0 iso 0 dist 5.86911 9.4835 13.1789 14.5108 19.5839 8.82096 9.46274 14.085 4.15355 9.06459 numMergedOcc 0
12 mol 214 unq 1 iso 0 dist 7.89258 9.4835 10.1543 14.5108 17.6894 8.82096 9.46274 12.4498 4.15355 9.06459 numMergedOcc 0
13 mol 239 unq 0 iso 0 dist 8.48545 9.27989 13.3838 12.1502 17.0305 6.16342 12.4909 15.5388 4.32238 4.43499 numMergedOcc 0
14 mol 277 unq 0 iso 0 dist 8.15119 8.35794 7.94155 5.77904 4.81916 9.7748 4.1545 9.21484 11.8607 4.9764 numMergedOcc 0
15 mol 277 unq 1 iso 0 dist 8.15119 8.35794 7.94155 5.77904 4.81916 9.7748 4.25172 10.3506 10.9137 6.36559 numMergedOcc 0
16 mol 280 unq 0 iso 0 dist 9.76967 9.26066 18.1328 12.5899 21.2961 6.53701 15.2678 23.2599 6.87492 6.01897 numMergedOcc 0
