0 mol 26 unq 0 iso 0 dist 9.46609 4.29919 9.5053 6.0606 6.38243 4.76998 numMergedOcc 0
1 mol 53 unq 0 iso 0 dist 9.23241 10.4112 7.75295 6.82319 6.2676 6.81798 numMergedOcc 0
2 mol 63 unq 0 iso 0 dist 5.9644 3.72318 5.53589 8.17555 7.4515 6.23298 numMergedOcc 0
3 mol 68 unq 0 iso 0 dist 5.74389 6.32283 6.40693 4.62009 8.05514 10.3533 numMergedOcc 0
4 mol 73 unq 0 iso 0 dist 6.53468 4.79924 7.62738 10.0936 7.69861 13.0054 numMergedOcc 0
5 mol 73 unq 1 iso 0 dist 5.90954 9.80492 7.62738 3.45332 7.69861 13.0054 numMergedOcc 0
6 mol 93 unq 0 iso 0 dist 8.42713 15.595 7.62611 3.91263 7.8435 14.9656 numMergedOcc 0
7 mol 93 unq 1 iso 0 dist 8.42713 15.595 7.62611 5.59024 5.99269 11.5397 numMergedOcc 0
8 mol 93 unq 2 iso 0 dist 8.42713 15.595 7.62611 12.9872 5.71763 5.43515 numMergedOcc 0
9 mol 93 unq 3 iso 0 dist 8.21032 4.38413 7.62611 15.8131 7.8435 14.9656 numMergedOcc 0
10 mol 93 unq 4 iso 0 dist 8.21032 4.38413 7.62611 13.6266 5.99269 11.5397 numMergedOcc 0
11 mol 93 unq 5 iso 0 dist 8.21032 4.38413 7.62611 5.17052 5.71763 5.43515 numMergedOcc 0
12 mol 130 unq 0 iso 0 dist 6.62468 12.1443 9.13191 8.17131 8.24966 6.39648 numMergedOcc 0
13 mol 130 unq 1 iso 0 dist 6.62468 11.0466 6.95405 8.17131 8.24966 10.3272 numMergedOcc 0
14 mol 147 unq 0 iso 0 dist 6.4752 10.7246 7.25644 11.5768 9.43989 3.88427 numMergedOcc 0
15 mol 158 unq 0 iso 0 dist 6.92225 4.31531 6.76055 9.02669 6.11331 11.3715 numMergedOcc 0
16 mol 158 unq 1 iso 0 dist 6.92225 9.29425 9.36343 9.02669 6.11331 14.1217 numMergedOcc 0
17 mol 194 unq 0 iso 0 dist 7.47107 10.7677 5.68348 12.1522 5.53324 4.002 numMergedOcc 0
18 mol 194 unq 1 iso 0 dist 7.47107 10.7677 5.68348 5.18485 6.72182 7.41775 numMergedOcc 0
19 mol 218 unq 0 iso 0 dist 9.6309 10.2441 9.32945 5.64434 8.04838 6.95765 numMergedOcc 0
20 mol 225 unq 0 iso 0 dist 8.28454 14.1101 9.23935 11.1052 9.87668 18.9885 numMergedOcc 0
21 mol 225 unq 1 iso 0 dist 8.28454 14.1101 9.23935 3.60045 8.42121 16.1303 numMergedOcc 0
22 mol 225 unq 2 iso 0 dist 8.28454 14.1101 9.23935 12.7272 7.8744 3.94409 numMergedOcc 0
23 mol 225 unq 3 iso 0 dist 8.28454 14.1101 9.23935 10.6169 4.98402 7.96454 numMergedOcc 0
24 mol 225 unq 4 iso 0 dist 8.28454 12.969 7.77552 11.1052 9.87668 17.5145 numMergedOcc 0
25 mol 225 unq 5 iso 0 dist 8.28454 12.969 7.77552 3.60045 8.42121 14.5337 numMergedOcc 0
26 mol 225 unq 6 iso 0 dist 8.28454 12.969 7.77552 12.7272 7.8744 6.88465 numMergedOcc 0
27 mol 225 unq 7 iso 0 dist 8.28454 12.969 7.77552 10.6169 4.98402 4.45116 numMergedOcc 0
28 mol 264 unq 0 iso 0 dist 8.28871 14.7332 7.21655 3.63202 7.14086 13.0036 numMergedOcc 0
29 mol 264 unq 1 iso 0 dist 7.94668 10.3515 7.21655 13.3131 7.14086 13.0036 numMergedOcc 0
30 mol 279 unq 0 iso 0 dist 5.63154 11.7377 9.30921 3.77031 5.8304 11.0079 numMergedOcc 0
31 mol 279 unq 1 iso 0 dist 5.63154 11.7377 9.30921 9.11782 7.37478 9.53157 numMergedOcc 0
