0 mol 11 unq 0 iso 0 dist 5.7435 11.1513 9.53002 13.4066 10.7048 4.79838 14.961 14.7815 8.05213 6.84216 numMergedOcc 0
1 mol 59 unq 0 iso 0 dist 9.59244 4.07863 6.23899 4.90216 11.6713 7.92479 10.9658 19.1676 14.9359 8.30217 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 8.2377 12.6436 5.64598 10.0651 3.85805 7.78587 4.99283 5.93252 9.77992 9.10566 numMergedOcc 0
3 mol 73 unq 1 iso 0 dist 8.2377 12.6436 5.64598 10.0651 3.85805 7.78587 9.98709 8.9232 13.4082 6.23522 numMergedOcc 0
4 mol 73 unq 2 iso 0 dist 8.2377 12.6436 5.64598 10.0651 3.85805 7.78587 15.5427 13.2207 17.0996 9.62027 numMergedOcc 0
5 mol 73 unq 3 iso 0 dist 6.18305 4.31731 4.65521 10.869 5.17781 7.78587 13.3852 11.379 9.77992 9.10566 numMergedOcc 0
6 mol 73 unq 4 iso 0 dist 6.18305 4.31731 4.65521 10.869 5.17781 7.78587 15.7901 10.2049 13.4082 6.23522 numMergedOcc 0
7 mol 73 unq 5 iso 0 dist 6.18305 4.31731 4.65521 10.869 5.17781 7.78587 19.2606 13.1757 17.0996 9.62027 numMergedOcc 0
8 mol 75 unq 0 iso 0 dist 6.95595 8.91765 5.15851 11.2061 4.74027 7.30467 12.7957 7.79912 10.0425 9.16597 numMergedOcc 0
9 mol 76 unq 0 iso 0 dist 6.4551 13.2281 9.49449 6.46582 3.69293 8.90522 8.78063 6.97941 6.06861 7.61521 numMergedOcc 0
10 mol 114 unq 0 iso 0 dist 9.44713 9.39191 8.68821 13.9615 10.5728 9.26486 5.74067 10.1937 9.2907 9.93438 numMergedOcc 0
11 mol 127 unq 0 iso 0 dist 9.42513 10.2034 9.81878 13.884 12.7606 7.79077 8.60326 9.30299 4.77464 5.39356 numMergedOcc 0
12 mol 127 unq 1 iso 0 dist 9.42513 10.2034 9.81878 13.884 12.7606 7.79077 12.7837 14.7391 7.11695 5.01504 numMergedOcc 0
13 mol 127 unq 2 iso 0 dist 9.42513 10.2034 9.81878 13.884 12.7606 7.79077 11.4002 14.9565 9.79266 6.80627 numMergedOcc 0
14 mol 218 unq 0 iso 0 dist 8.5119 11.711 7.17547 20.2276 14.5747 8.5244 16.8077 10.9501 7.47048 7.84952 numMergedOcc 0
15 mol 235 unq 0 iso 0 dist 8.48065 5.52698 8.21247 8.1174 4.75609 9.11149 5.23741 5.4638 4.65302 8.08965 numMergedOcc 0
16 mol 259 unq 0 iso 0 dist 6.42725 7.53102 6.77938 9.9749 5.96249 8.22608 8.70769 5.30224 4.99891 9.18798 numMergedOcc 0
17 mol 259 unq 1 iso 0 dist 6.42725 7.53102 6.77938 6.69951 5.97386 5.23503 8.70769 5.30224 4.99891 8.25897 numMergedOcc 0
18 mol 259 unq 2 iso 0 dist 6.42725 6.58569 7.76676 6.69951 5.97386 9.61028 8.70769 5.30224 5.32839 8.25897 numMergedOcc 0
19 mol 265 unq 0 iso 0 dist 9.772 5.55314 6.34034 5.8898 7.71667 8.03604 5.75478 8.4218 6.43013 5.7944 numMergedOcc 0
20 mol 277 unq 0 iso 0 dist 9.29635 13.8592 9.41725 5.11998 7.75371 9.62597 14.2115 12.5685 10.7791 9.54359 numMergedOcc 0
21 mol 277 unq 1 iso 0 dist 9.29635 13.8592 9.41725 5.11998 7.75371 9.62597 10.8075 9.7748 6.58374 5.69112 numMergedOcc 0
