0 mol 4 unq 0 iso 0 dist 6.10734 6.21799 5.58487 10.8791 7.35416 5.70412 numMergedOcc 0
1 mol 10 unq 0 iso 0 dist 5.66059 6.178 5.40169 6.77258 5.59965 9.61828 numMergedOcc 0
2 mol 10 unq 1 iso 0 dist 5.99743 5.45654 8.00369 5.16967 5.59965 7.99067 numMergedOcc 0
3 mol 26 unq 0 iso 0 dist 9.7004 10.2996 6.74848 6.81961 6.56527 5.45023 numMergedOcc 0
4 mol 44 unq 0 iso 0 dist 5.81645 5.75226 7.03307 5.51351 7.48846 5.1728 numMergedOcc 0
5 mol 48 unq 0 iso 0 dist 9.98874 9.6372 7.59316 12.7242 8.29857 4.16161 numMergedOcc 0
6 mol 68 unq 0 iso 0 dist 8.67118 11.7387 8.91427 9.54097 6.74766 7.53895 numMergedOcc 0
7 mol 76 unq 0 iso 0 dist 4.73362 7.18485 9.75201 4.72225 8.95905 7.2505 numMergedOcc 0
8 mol 76 unq 1 iso 0 dist 7.3795 12.7451 9.75201 8.81518 8.95905 7.2505 numMergedOcc 0
9 mol 92 unq 0 iso 0 dist 6.48163 12.5077 9.05259 5.60494 6.77241 8.0763 numMergedOcc 0
10 mol 92 unq 1 iso 0 dist 6.48163 12.5077 9.05259 4.76916 5.50508 12.2082 numMergedOcc 0
11 mol 98 unq 0 iso 0 dist 8.48678 13.9427 8.43352 8.83348 7.36769 8.02554 numMergedOcc 0
12 mol 98 unq 1 iso 0 dist 8.48678 13.9427 8.43352 14.016 6.88901 11.2092 numMergedOcc 0
13 mol 98 unq 2 iso 0 dist 6.04768 10.8678 6.62972 4.81103 7.14031 8.53212 numMergedOcc 0
14 mol 98 unq 3 iso 0 dist 9.40173 13.5865 6.62972 7.22196 7.14031 8.53212 numMergedOcc 0
15 mol 119 unq 0 iso 0 dist 8.05937 5.53632 9.9151 7.21894 7.20249 4.99495 numMergedOcc 0
16 mol 141 unq 0 iso 0 dist 7.38183 10.8036 6.73983 14.0112 6.75376 8.69924 numMergedOcc 0
17 mol 141 unq 1 iso 0 dist 7.38183 12.1363 8.6387 14.0112 6.75376 9.33878 numMergedOcc 0
18 mol 156 unq 0 iso 0 dist 8.32841 14.911 7.46845 5.309 8.21184 12.4049 numMergedOcc 0
19 mol 156 unq 1 iso 0 dist 8.32841 14.911 7.46845 6.07262 5.9976 11.7015 numMergedOcc 0
20 mol 156 unq 2 iso 0 dist 6.56065 11.1159 7.46845 11.9245 8.21184 12.4049 numMergedOcc 0
21 mol 156 unq 3 iso 0 dist 6.56065 11.1159 7.46845 6.25291 5.9976 11.7015 numMergedOcc 0
22 mol 186 unq 0 iso 0 dist 8.09667 5.37893 5.45675 5.96605 6.21159 5.81211 numMergedOcc 0
23 mol 193 unq 0 iso 0 dist 6.28889 11.6364 8.67745 9.7127 9.40801 6.03632 numMergedOcc 0
24 mol 193 unq 1 iso 0 dist 6.28889 8.4769 9.41624 9.7127 9.40801 7.58433 numMergedOcc 0
25 mol 194 unq 0 iso 0 dist 9.819 11.802 6.37788 14.3175 6.1886 8.43261 numMergedOcc 0
26 mol 194 unq 1 iso 0 dist 9.819 12.0623 8.7028 14.3175 6.1886 13.8424 numMergedOcc 0
27 mol 226 unq 0 iso 0 dist 6.82883 7.21532 6.26945 4.97624 5.70795 6.85639 numMergedOcc 0
28 mol 226 unq 1 iso 0 dist 8.22518 12.0613 6.26945 5.55393 5.70795 6.85639 numMergedOcc 0
29 mol 226 unq 2 iso 0 dist 6.02803 10.6196 6.26945 9.35407 5.70795 6.85639 numMergedOcc 0
