0 mol 16 unq 0 iso 0 dist 6.84569 5.66529 6.58035 6.32814 8.41862 10.9633 11.8413 10.7015 7.03948 17.3012 numMergedOcc 0
1 mol 16 unq 1 iso 0 dist 6.84569 5.66529 6.58035 6.32814 8.41862 10.9633 9.59856 5.32694 5.47769 13.0191 numMergedOcc 0
2 mol 16 unq 2 iso 0 dist 6.84569 6.32814 8.41862 5.66529 6.58035 10.9633 10.5516 5.74188 8.16785 12.1189 numMergedOcc 0
3 mol 70 unq 0 iso 0 dist 7.63663 14.4842 7.92394 14.7467 9.93423 4.25121 12.2091 5.22626 8.33704 11.6205 numMergedOcc 0
4 mol 70 unq 1 iso 0 dist 7.63663 14.4842 7.92394 5.93792 9.34122 13.6636 12.2091 5.22626 8.33704 13.4942 numMergedOcc 0
5 mol 76 unq 0 iso 0 dist 5.56964 7.5192 8.19682 11.2136 8.97793 5.67347 8.41567 10.2879 6.21982 11.062 numMergedOcc 0
6 mol 115 unq 0 iso 0 dist 8.97043 7.266 9.66954 11.6637 7.64585 12.0796 12.9647 7.69052 8.66155 12.2309 numMergedOcc 0
7 mol 131 unq 0 iso 0 dist 8.99949 9.45501 6.91348 9.03202 9.51418 10.2027 15.0798 6.63273 8.6243 12.9472 numMergedOcc 0
8 mol 155 unq 0 iso 0 dist 5.68636 6.79302 7.36102 7.441 9.38946 5.68272 13.3396 10.7616 7.39644 11.5473 numMergedOcc 0
9 mol 218 unq 0 iso 0 dist 8.2088 7.85937 7.13323 5.22669 9.50586 4.63933 9.82905 7.83217 7.17547 9.29802 numMergedOcc 0
10 mol 238 unq 0 iso 0 dist 8.96639 12.8735 9.68513 10.761 5.9216 4.83721 12.6253 10.1648 9.29858 10.7386 numMergedOcc 0
11 mol 238 unq 1 iso 0 dist 8.96639 10.761 5.9216 12.8735 9.68513 4.83721 5.67917 5.40359 9.90142 12.5477 numMergedOcc 0
12 mol 238 unq 2 iso 0 dist 7.64276 13.9044 6.55759 13.3748 7.02475 6.44245 11.4704 5.42006 5.38637 9.98024 numMergedOcc 0
13 mol 238 unq 3 iso 0 dist 7.64276 13.9044 6.55759 11.6924 7.67322 10.677 11.4704 5.42006 5.38637 12.0632 numMergedOcc 0
14 mol 238 unq 4 iso 0 dist 7.64276 13.9044 6.55759 5.61491 7.19008 12.1411 11.4704 5.42006 5.38637 12.0365 numMergedOcc 0
15 mol 238 unq 5 iso 0 dist 7.64276 13.3748 7.02475 13.9044 6.55759 6.44245 15.4736 12.9854 8.96531 13.9201 numMergedOcc 0
16 mol 238 unq 6 iso 0 dist 7.64276 13.3748 7.02475 11.6924 7.67322 5.44694 15.4736 12.9854 8.96531 10.0552 numMergedOcc 0
17 mol 238 unq 7 iso 0 dist 7.64276 13.3748 7.02475 5.61491 7.19008 10.1756 15.4736 12.9854 8.96531 10.0962 numMergedOcc 0
18 mol 238 unq 8 iso 0 dist 7.64276 5.61491 7.19008 13.9044 6.55759 12.1411 4.87108 5.34096 7.49471 10.5202 numMergedOcc 0
19 mol 238 unq 9 iso 0 dist 7.64276 5.61491 7.19008 13.3748 7.02475 10.1756 4.87108 5.34096 7.49471 12.1784 numMergedOcc 0
20 mol 238 unq 10 iso 0 dist 7.64276 5.61491 7.19008 11.6924 7.67322 9.50847 4.87108 5.34096 7.49471 12.1937 numMergedOcc 0
21 mol 240 unq 0 iso 0 dist 9.68888 13.7594 6.15305 5.59975 8.0951 11.0721 13.7335 4.28414 7.03489 12.1358 numMergedOcc 0
22 mol 272 unq 0 iso 0 dist 7.31993 13.7563 9.09992 5.91451 6.16449 9.75529 12.3168 5.40809 6.73206 10.1966 numMergedOcc 0
