0 mol 64 unq 0 iso 0 dist 5.66803 8.61926 4.56868 6.33529 9.15386 13.4856 numMergedOcc 0
1 mol 64 unq 1 iso 0 dist 5.41357 8.64746 4.97497 9.95527 8.75668 8.68586 numMergedOcc 0
2 mol 64 unq 2 iso 0 dist 5.41357 8.64746 4.97497 6.41829 9.64871 9.54144 numMergedOcc 0
3 mol 64 unq 3 iso 0 dist 5.41357 8.64746 4.97497 6.13923 9.95118 11.3063 numMergedOcc 0
4 mol 75 unq 0 iso 0 dist 8.25597 8.26819 8.88127 5.56574 9.20448 5.15851 numMergedOcc 0
5 mol 75 unq 1 iso 0 dist 4.76466 8.26819 6.78257 5.56574 6.96759 5.15851 numMergedOcc 0
6 mol 75 unq 2 iso 0 dist 8.67172 8.26819 4.7798 5.56574 6.97318 5.15851 numMergedOcc 0
7 mol 92 unq 0 iso 0 dist 8.15664 6.00131 6.85223 6.09495 7.11695 8.36431 numMergedOcc 0
8 mol 101 unq 0 iso 0 dist 7.1859 7.43143 4.09052 4.51951 8.65215 10.6222 numMergedOcc 0
9 mol 101 unq 1 iso 0 dist 7.1859 7.43143 4.09052 5.82598 9.65097 9.57816 numMergedOcc 0
10 mol 105 unq 0 iso 0 dist 6.1083 7.81122 11.0122 11.0473 8.67414 16.424 numMergedOcc 0
11 mol 105 unq 1 iso 0 dist 6.11833 9.3724 6.10266 11.5147 9.94398 12.1449 numMergedOcc 0
12 mol 116 unq 0 iso 0 dist 6.90966 9.78909 6.71263 6.29219 9.64597 14.9085 numMergedOcc 0
13 mol 129 unq 0 iso 0 dist 9.52061 7.65371 13.0969 5.99695 8.59695 10.1104 numMergedOcc 0
14 mol 187 unq 0 iso 0 dist 5.58167 6.56642 6.47437 4.98423 6.82787 10.8351 numMergedOcc 0
15 mol 187 unq 1 iso 0 dist 5.58167 7.9625 10.7843 4.98423 6.82787 9.27478 numMergedOcc 0
16 mol 195 unq 0 iso 0 dist 7.2833 9.71653 6.80353 5.34788 7.04524 12.4119 numMergedOcc 0
17 mol 204 unq 0 iso 0 dist 6.20044 9.01377 13.2711 6.12296 9.24822 14.1903 numMergedOcc 0
18 mol 220 unq 0 iso 0 dist 5.25149 5.00266 4.51612 6.19375 5.39218 6.99002 numMergedOcc 0
19 mol 220 unq 1 iso 0 dist 6.80214 5.91133 7.67444 14.1934 9.9693 16.047 numMergedOcc 0
20 mol 224 unq 0 iso 0 dist 6.23677 8.76325 4.76056 6.87755 7.49783 7.06793 numMergedOcc 0
21 mol 224 unq 1 iso 0 dist 7.31608 8.85101 4.76056 11.0252 7.49783 7.06793 numMergedOcc 0
22 mol 236 unq 0 iso 0 dist 4.71683 5.77356 4.71339 5.52669 9.44496 10.6445 numMergedOcc 0
23 mol 236 unq 1 iso 0 dist 4.71683 5.77356 4.71339 7.77821 7.87233 5.34718 numMergedOcc 0
24 mol 236 unq 2 iso 0 dist 4.71683 9.24309 11.3543 5.52669 9.44496 10.5433 numMergedOcc 0
25 mol 236 unq 3 iso 0 dist 4.71683 9.24309 11.3543 7.77821 7.87233 10.5713 numMergedOcc 0
26 mol 239 unq 0 iso 0 dist 9.01071 4.57548 11.2678 8.70119 6.29774 11.0695 numMergedOcc 0
27 mol 239 unq 1 iso 0 dist 9.01071 4.57548 11.2678 10.1972 9.28258 14.3009 numMergedOcc 0
28 mol 259 unq 0 iso 0 dist 9.86267 9.44826 3.83813 7.02254 6.11671 7.50578 numMergedOcc 0
29 mol 293 unq 0 iso 0 dist 4.72125 5.50284 5.86908 5.66805 5.44043 8.56847 numMergedOcc 0
30 mol 293 unq 1 iso 0 dist 4.72125 8.88355 10.4612 5.66805 5.44043 14.1253 numMergedOcc 0
31 mol 293 unq 2 iso 0 dist 6.52889 7.44889 6.42397 9.51167 9.25564 8.56847 numMergedOcc 0
