0 mol 7 unq 0 iso 0 dist 7.10621 5.72491 5.44992 12.2041 12.2333 7.88043 14.0084 15.9781 10.6558 7.78327 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 7.36323 9.24958 4.33963 12.3067 5.54419 4.93188 10.551 6.7846 4.21283 8.23075 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 7.36323 9.24958 4.33963 12.3067 5.54419 4.93188 14.1707 8.03955 4.97191 4.7841 numMergedOcc 0
3 mol 25 unq 0 iso 0 dist 7.57578 6.90155 9.36158 10.6808 13.7311 5.81959 13.2158 13.8191 6.32857 7.03372 numMergedOcc 0
4 mol 25 unq 1 iso 0 dist 7.17969 6.90155 10.1525 10.6808 12.9968 5.81959 13.2158 15.1436 6.32857 7.03372 numMergedOcc 0
5 mol 43 unq 0 iso 0 dist 5.73819 8.60739 5.64171 8.13395 10.5523 9.93832 11.4251 9.80379 6.59887 7.39848 numMergedOcc 0
6 mol 43 unq 1 iso 0 dist 6.20293 8.60739 9.06158 8.13395 8.80331 9.93832 11.4251 9.86609 6.59887 7.39848 numMergedOcc 0
7 mol 43 unq 2 iso 0 dist 8.93915 8.60739 11.3891 8.13395 14.7803 9.93832 11.4251 14.7764 6.59887 7.39848 numMergedOcc 0
8 mol 73 unq 0 iso 0 dist 8.70481 8.85586 14.8866 8.07446 16.0098 5.16364 7.37171 15.1432 12.6176 8.62079 numMergedOcc 0
9 mol 85 unq 0 iso 0 dist 7.97049 7.1589 6.37974 4.26409 11.3023 8.00777 9.90583 10.3737 4.06365 9.01812 numMergedOcc 0
10 mol 85 unq 1 iso 0 dist 6.19965 7.1589 5.08358 4.26409 7.95579 8.00777 9.90583 8.37717 4.06365 9.01812 numMergedOcc 0
11 mol 109 unq 0 iso 0 dist 8.69985 5.34214 9.14441 4.98336 13.4572 7.55384 9.56598 12.4093 6.30703 9.63963 numMergedOcc 0
12 mol 112 unq 0 iso 0 dist 9.60462 9.92283 17.3924 5.0812 13.9874 6.43433 11.5809 19.2759 4.25001 6.87434 numMergedOcc 0
13 mol 131 unq 0 iso 0 dist 7.12972 6.92648 9.32969 6.63273 6.85062 9.29384 12.9064 11.6692 9.6795 8.80895 numMergedOcc 0
14 mol 152 unq 0 iso 0 dist 5.87555 8.28642 5.70788 7.65448 10.399 9.77552 11.2397 9.75376 6.69469 7.55934 numMergedOcc 0
15 mol 152 unq 1 iso 0 dist 6.70283 8.28642 9.35627 7.65448 8.56324 9.77552 11.2397 9.73449 6.69469 7.55934 numMergedOcc 0
16 mol 152 unq 2 iso 0 dist 8.67331 8.28642 11.2078 7.65448 14.1618 9.77552 11.2397 14.5097 6.69469 7.55934 numMergedOcc 0
17 mol 186 unq 0 iso 0 dist 9.09754 8.64409 9.97575 13.684 16.9992 7.24795 17.3863 18.5746 9.28201 5.90765 numMergedOcc 0
18 mol 205 unq 0 iso 0 dist 6.03031 8.44861 5.28092 7.38516 7.26832 5.60393 13.3708 13.3822 12.0319 7.13783 numMergedOcc 0
19 mol 248 unq 0 iso 0 dist 7.69895 6.17052 5.99459 5.55137 7.21521 9.77666 7.79063 6.19721 4.91893 9.64778 numMergedOcc 0
20 mol 248 unq 1 iso 0 dist 7.21521 9.77666 5.99459 5.55137 7.69895 6.17052 9.64778 6.19721 4.91893 7.79063 numMergedOcc 0
21 mol 261 unq 0 iso 0 dist 9.14619 5.26434 6.04016 7.00201 8.45658 8.60026 12.3855 11.4108 11.1232 8.24356 numMergedOcc 0
