0 mol 26 unq 0 iso 0 dist 6.88695 5.3315 8.34347 6.66387 9.16962 11.887 11.1296 15.962 15.4381 7.84204 numMergedOcc 0
1 mol 73 unq 0 iso 0 dist 8.2377 4.99283 5.93252 12.6436 5.64598 9.77992 10.0651 3.85805 9.10566 7.78587 numMergedOcc 0
2 mol 73 unq 1 iso 0 dist 6.18305 4.69583 6.19304 4.31731 4.65521 7.41074 10.869 5.17781 11.3218 7.78587 numMergedOcc 0
3 mol 75 unq 0 iso 0 dist 6.95595 12.7957 7.79912 8.91765 5.15851 10.0425 11.2061 4.74027 9.16597 7.30467 numMergedOcc 0
4 mol 75 unq 1 iso 0 dist 6.95595 10.309 8.56639 8.91765 5.15851 11.8774 11.2061 4.74027 11.7473 7.30467 numMergedOcc 0
5 mol 75 unq 2 iso 0 dist 6.95595 5.80162 8.59017 8.91765 5.15851 10.0372 11.2061 4.74027 13.2779 7.30467 numMergedOcc 0
6 mol 76 unq 0 iso 0 dist 6.4551 8.78063 6.97941 13.2281 9.49449 6.06861 6.46582 3.69293 7.61521 8.90522 numMergedOcc 0
7 mol 114 unq 0 iso 0 dist 9.44713 4.1386 7.35754 9.39191 8.68821 5.33327 13.9615 10.5728 10.7946 9.26486 numMergedOcc 0
8 mol 127 unq 0 iso 0 dist 9.42513 8.60326 9.30299 10.2034 9.81878 4.77464 13.884 12.7606 5.39356 7.79077 numMergedOcc 0
9 mol 220 unq 0 iso 0 dist 7.16386 9.02283 9.41367 3.90017 7.61951 7.08796 9.19289 4.86965 13.3238 9.43419 numMergedOcc 0
10 mol 234 unq 0 iso 0 dist 7.86368 12.0816 9.45496 16.9465 9.5707 15.9563 19.2408 12.7879 18.009 5.69634 numMergedOcc 0
11 mol 234 unq 1 iso 0 dist 7.86368 12.0816 9.45496 15.442 7.85175 11.216 19.2408 12.7879 18.009 7.91374 numMergedOcc 0
12 mol 234 unq 2 iso 0 dist 7.86368 6.94762 6.7625 16.9465 9.5707 14.4106 19.2408 12.7879 15.3921 5.69634 numMergedOcc 0
13 mol 234 unq 3 iso 0 dist 7.86368 6.94762 6.7625 15.442 7.85175 11.4315 19.2408 12.7879 15.3921 7.91374 numMergedOcc 0
14 mol 235 unq 0 iso 0 dist 8.48065 5.23741 5.4638 5.52698 8.21247 4.65302 8.1174 4.75609 8.08965 9.11149 numMergedOcc 0
15 mol 256 unq 0 iso 0 dist 7.67598 8.99993 8.29103 9.40096 5.24676 4.22352 13.3942 6.73995 8.97872 5.85613 numMergedOcc 0
16 mol 259 unq 0 iso 0 dist 9.12507 5.59901 5.30224 4.09442 8.37865 5.31048 12.7634 9.53031 11.1801 9.28024 numMergedOcc 0
17 mol 259 unq 1 iso 0 dist 6.42725 8.70769 5.30224 7.53102 6.77938 4.99891 9.9749 5.96249 9.18798 8.22608 numMergedOcc 0
18 mol 259 unq 2 iso 0 dist 6.42725 8.70769 5.30224 7.53102 6.77938 4.99891 6.69951 5.97386 8.25897 5.23503 numMergedOcc 0
19 mol 259 unq 3 iso 0 dist 6.42725 8.70769 5.30224 6.58569 7.76676 5.32839 6.69951 5.97386 8.25897 9.61028 numMergedOcc 0
20 mol 264 unq 0 iso 0 dist 8.43858 10.2215 9.361 15.8008 9.5784 9.85579 18.2223 11.147 11.9373 8.56867 numMergedOcc 0
21 mol 264 unq 1 iso 0 dist 8.43858 10.2215 9.361 15.8008 9.5784 9.85579 17.6227 10.0018 11.9269 6.29872 numMergedOcc 0
22 mol 264 unq 2 iso 0 dist 8.43858 8.55312 6.24356 15.8008 9.5784 9.67998 18.2223 11.147 15.2551 8.56867 numMergedOcc 0
23 mol 264 unq 3 iso 0 dist 8.43858 8.55312 6.24356 15.8008 9.5784 9.67998 17.6227 10.0018 13.3874 6.29872 numMergedOcc 0
24 mol 265 unq 0 iso 0 dist 9.772 5.75478 8.4218 5.55314 6.34034 6.43013 5.8898 7.71667 5.7944 8.03604 numMergedOcc 0
25 mol 277 unq 0 iso 0 dist 9.29635 10.8075 9.7748 13.8592 9.41725 6.58374 5.11998 7.75371 5.69112 9.62597 numMergedOcc 0
