0 mol 10 unq 0 iso 0 dist 5.40169 9.61828 5.59965 11.4402 9.43029 4.99208 6.02543 3.92592 6.18431 9.39486 numMergedOcc 0
1 mol 10 unq 1 iso 0 dist 8.00369 7.99067 5.59965 9.69704 6.18431 3.92592 10.0328 5.83346 9.26127 7.14537 numMergedOcc 0
2 mol 10 unq 2 iso 0 dist 8.00369 7.99067 5.59965 9.69704 6.18431 3.92592 12.8238 4.99208 9.43029 9.39486 numMergedOcc 0
3 mol 26 unq 0 iso 0 dist 9.5053 5.66783 6.56527 13.4114 6.7142 10.0347 13.9894 5.39199 9.82888 8.96682 numMergedOcc 0
4 mol 30 unq 0 iso 0 dist 6.55815 5.60789 7.14464 8.85891 9.4577 4.02746 9.53223 9.01474 5.22979 7.27243 numMergedOcc 0
5 mol 68 unq 0 iso 0 dist 8.91427 7.53895 6.74766 8.69385 7.98985 12.5617 12.1884 7.71726 13.7421 5.7369 numMergedOcc 0
6 mol 76 unq 0 iso 0 dist 9.75201 7.2505 8.95905 6.48293 7.46095 6.6642 15.0426 10.1364 15.2551 9.59729 numMergedOcc 0
7 mol 92 unq 0 iso 0 dist 8.29345 9.01596 9.91054 8.08435 8.93769 11.9597 11.7337 4.52323 12.2123 8.89015 numMergedOcc 0
8 mol 112 unq 0 iso 0 dist 9.77017 7.22444 7.80873 9.00531 6.11407 5.08111 15.703 10.4943 9.26353 7.31064 numMergedOcc 0
9 mol 134 unq 0 iso 0 dist 9.30061 14.2253 6.40575 4.935 9.0176 15.0575 5.11043 6.93712 10.1824 8.62504 numMergedOcc 0
10 mol 141 unq 0 iso 0 dist 7.64956 8.69924 9.10042 8.48213 6.65731 14.0725 15.0988 10.0208 17.2659 7.92216 numMergedOcc 0
11 mol 141 unq 1 iso 0 dist 7.64956 9.41497 9.75059 8.48213 6.65731 13.1981 15.0988 10.0208 15.2695 7.92216 numMergedOcc 0
12 mol 141 unq 2 iso 0 dist 7.64956 9.53115 6.83404 8.48213 6.65731 3.98068 15.0988 10.0208 5.92302 7.92216 numMergedOcc 0
13 mol 141 unq 3 iso 0 dist 4.46777 5.38571 6.83404 5.25982 5.92302 10.0208 6.77921 3.98068 6.65731 7.92216 numMergedOcc 0
14 mol 225 unq 0 iso 0 dist 9.23935 8.98957 8.37739 6.05548 9.82043 5.8463 7.8744 3.94409 6.94762 9.3502 numMergedOcc 0
15 mol 225 unq 1 iso 0 dist 9.23935 8.98957 8.37739 6.05548 9.82043 5.8463 12.6753 8.31193 9.89167 9.34821 numMergedOcc 0
16 mol 225 unq 2 iso 0 dist 9.23935 8.98957 8.37739 6.05548 9.82043 5.8463 4.98402 7.96454 10.1785 6.46405 numMergedOcc 0
17 mol 225 unq 3 iso 0 dist 7.77552 8.98957 9.47237 6.05548 8.22922 5.8463 7.8744 6.88465 6.94762 9.3502 numMergedOcc 0
18 mol 225 unq 4 iso 0 dist 7.77552 8.98957 9.47237 6.05548 8.22922 5.8463 12.6753 6.8122 9.89167 9.34821 numMergedOcc 0
19 mol 225 unq 5 iso 0 dist 7.77552 8.98957 9.47237 6.05548 8.22922 5.8463 4.98402 4.45116 10.1785 6.46405 numMergedOcc 0
20 mol 277 unq 0 iso 0 dist 7.85414 5.43373 8.20644 14.6871 9.26157 16.0346 13.6334 6.64795 12.5241 7.16209 numMergedOcc 0
