0 mol 0 unq 0 iso 0 dist 7.31837 5.66453 6.64713 9.42137 5.24778 6.26831 numMergedOcc 0
1 mol 9 unq 0 iso 0 dist 9.8978 5.3866 8.076 11.8248 8.50424 7.05346 numMergedOcc 0
2 mol 9 unq 1 iso 0 dist 9.8978 10.6991 6.32226 13.9579 6.02809 7.9944 numMergedOcc 0
3 mol 9 unq 2 iso 0 dist 9.8978 10.6991 6.32226 14.5722 4.98827 7.032 numMergedOcc 0
4 mol 9 unq 3 iso 0 dist 6.26276 6.49896 8.076 10.068 8.50424 7.05346 numMergedOcc 0
5 mol 9 unq 4 iso 0 dist 6.26276 5.55187 6.32226 10.1307 6.02809 7.9944 numMergedOcc 0
6 mol 9 unq 5 iso 0 dist 6.26276 5.55187 6.32226 10.1367 4.98827 7.032 numMergedOcc 0
7 mol 9 unq 6 iso 0 dist 9.99657 13.823 5.71201 12.1945 5.67536 9.27637 numMergedOcc 0
8 mol 26 unq 0 iso 0 dist 9.44507 14.6525 9.5053 9.7522 10.9837 8.44506 numMergedOcc 0
9 mol 44 unq 0 iso 0 dist 9.45566 6.36853 7.03307 9.44909 4.55437 7.52117 numMergedOcc 0
10 mol 58 unq 0 iso 0 dist 5.84625 9.05877 6.62229 10.3132 5.85698 7.27383 numMergedOcc 0
11 mol 76 unq 0 iso 0 dist 7.75211 5.25697 6.66954 8.58841 4.3931 4.79949 numMergedOcc 0
12 mol 98 unq 0 iso 0 dist 5.94696 11.7159 8.43352 12.3884 7.06961 7.26086 numMergedOcc 0
13 mol 100 unq 0 iso 0 dist 9.16592 15.7109 9.5669 18.1028 9.75737 7.12017 numMergedOcc 0
14 mol 112 unq 0 iso 0 dist 5.42828 6.84906 9.77017 7.15985 5.39346 8.729 numMergedOcc 0
15 mol 114 unq 0 iso 0 dist 8.27794 11.393 9.35942 16.414 12.7083 6.34525 numMergedOcc 0
16 mol 114 unq 1 iso 0 dist 8.27794 13.5888 7.42482 11.6982 7.12268 9.7918 numMergedOcc 0
17 mol 115 unq 0 iso 0 dist 6.66022 5.01124 8.85881 4.98864 5.22052 5.74857 numMergedOcc 0
18 mol 119 unq 0 iso 0 dist 8.4733 6.64646 9.9151 6.40546 7.45148 7.99623 numMergedOcc 0
19 mol 120 unq 0 iso 0 dist 8.73484 4.63594 6.03352 7.04864 8.2619 8.93905 numMergedOcc 0
20 mol 126 unq 0 iso 0 dist 8.97111 5.93497 5.94233 8.32241 6.0268 9.46588 numMergedOcc 0
21 mol 147 unq 0 iso 0 dist 9.41073 15.2038 7.25644 19.8549 11.1681 5.49226 numMergedOcc 0
22 mol 147 unq 1 iso 0 dist 9.41073 15.2038 7.25644 14.5535 5.50251 6.28351 numMergedOcc 0
23 mol 162 unq 0 iso 0 dist 8.63323 5.5367 8.57005 9.97921 6.07158 6.20182 numMergedOcc 0
24 mol 162 unq 1 iso 0 dist 9.76987 12.8058 8.57005 14.2752 6.07158 6.20182 numMergedOcc 0
25 mol 220 unq 0 iso 0 dist 7.4513 5.37508 5.37796 10.6535 7.11498 5.45036 numMergedOcc 0
26 mol 253 unq 0 iso 0 dist 9.69704 9.82329 8.15091 7.15815 5.78064 7.77998 numMergedOcc 0
27 mol 257 unq 0 iso 0 dist 9.34004 5.21929 9.43042 12.6087 6.74593 9.69696 numMergedOcc 0
28 mol 258 unq 0 iso 0 dist 9.58735 5.67781 9.91199 10.2123 10.8558 6.70815 numMergedOcc 0
29 mol 258 unq 1 iso 0 dist 9.58735 5.67781 9.91199 13.5424 13.2927 7.99477 numMergedOcc 0
30 mol 258 unq 2 iso 0 dist 8.12414 4.88527 9.91199 10.6749 10.8558 6.70815 numMergedOcc 0
31 mol 258 unq 3 iso 0 dist 8.12414 4.88527 9.91199 11.4077 13.2927 7.99477 numMergedOcc 0
