0 mol 43 unq 0 iso 0 dist 9.72346 5.5249 7.39848 8.06275 9.86609 8.80331 8.60781 16.4643 10.4442 9.83618 numMergedOcc 0
1 mol 43 unq 1 iso 0 dist 7.45173 5.46715 7.39848 13.5835 9.86609 8.80331 15.5227 16.4643 10.4442 9.83618 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 9.73501 6.67306 6.23522 10.0143 4.73407 9.38498 15.7928 7.78587 13.4082 8.70133 numMergedOcc 0
3 mol 73 unq 1 iso 0 dist 9.73501 17.6159 9.10566 13.2197 3.85805 5.93252 15.7928 7.78587 9.77992 5.64598 numMergedOcc 0
4 mol 102 unq 0 iso 0 dist 9.00369 8.90571 5.54256 8.84131 3.48119 7.36792 6.87786 7.68537 5.498 9.94856 numMergedOcc 0
5 mol 127 unq 0 iso 0 dist 8.87379 10.3931 5.39356 19.5766 12.7606 9.30299 12.8824 7.79077 4.77464 9.81878 numMergedOcc 0
6 mol 142 unq 0 iso 0 dist 6.4119 12.8283 8.04118 4.93681 4.05822 9.2313 6.17441 5.69323 9.49653 7.15475 numMergedOcc 0
7 mol 142 unq 1 iso 0 dist 6.4119 12.8283 8.04118 9.86383 4.7832 5.31024 6.17441 5.69323 9.49653 9.07935 numMergedOcc 0
8 mol 142 unq 2 iso 0 dist 6.4119 10.1677 8.39035 4.93681 4.05822 7.73169 6.17441 5.69323 7.53854 7.15475 numMergedOcc 0
9 mol 142 unq 3 iso 0 dist 6.4119 10.1677 8.39035 9.86383 4.7832 7.26382 6.17441 5.69323 7.53854 9.07935 numMergedOcc 0
10 mol 142 unq 4 iso 0 dist 8.40522 7.17212 8.04118 11.9068 4.05822 9.2313 8.84953 5.69323 9.49653 7.15475 numMergedOcc 0
11 mol 142 unq 5 iso 0 dist 8.40522 7.17212 8.04118 9.11832 4.7832 5.31024 8.84953 5.69323 9.49653 9.07935 numMergedOcc 0
12 mol 142 unq 6 iso 0 dist 8.40522 10.4957 8.39035 11.9068 4.05822 7.73169 8.84953 5.69323 7.53854 7.15475 numMergedOcc 0
13 mol 142 unq 7 iso 0 dist 8.40522 10.4957 8.39035 9.11832 4.7832 7.26382 8.84953 5.69323 7.53854 9.07935 numMergedOcc 0
14 mol 205 unq 0 iso 0 dist 4.72209 4.84308 7.13783 11.1839 13.3822 7.26832 9.77514 12.4189 6.23291 9.19704 numMergedOcc 0
15 mol 235 unq 0 iso 0 dist 8.28824 6.70342 8.08965 6.45574 4.75609 5.4638 5.61388 9.11149 4.65302 8.21247 numMergedOcc 0
16 mol 248 unq 0 iso 0 dist 8.28099 5.8982 7.79063 10.1466 6.19721 7.69895 10.6288 10.7209 6.48757 6.07192 numMergedOcc 0
17 mol 248 unq 1 iso 0 dist 8.28099 6.17735 9.64778 10.1466 6.19721 7.21521 10.6288 10.7209 5.51827 6.07192 numMergedOcc 0
18 mol 248 unq 2 iso 0 dist 5.76741 7.63032 7.79063 7.40475 6.19721 7.69895 10.2858 10.7209 6.48757 6.07192 numMergedOcc 0
19 mol 248 unq 3 iso 0 dist 5.76741 6.42334 9.64778 7.40475 6.19721 7.21521 10.2858 10.7209 5.51827 6.07192 numMergedOcc 0
20 mol 261 unq 0 iso 0 dist 8.55479 6.39263 8.24356 9.80409 11.4108 8.45658 9.66751 12.8776 5.22253 7.47164 numMergedOcc 0
21 mol 265 unq 0 iso 0 dist 5.44039 4.05162 5.7944 8.49415 7.71667 8.4218 9.3596 8.03604 6.43013 6.34034 numMergedOcc 0
22 mol 277 unq 0 iso 0 dist 7.73997 12.7143 7.2091 18.3414 11.3546 9.7748 15.847 11.5874 6.58374 9.41725 numMergedOcc 0
