0 mol 5 unq 0 iso 0 dist 9.64713 5.2392 5.30596 3.67097 12.1799 7.50453 numMergedOcc 0
1 mol 10 unq 0 iso 0 dist 9.31452 6.50444 4.75564 3.5691 8.98746 6.77807 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 8.62527 9.90986 8.90517 3.30063 8.36742 8.97754 numMergedOcc 0
3 mol 28 unq 0 iso 0 dist 7.43758 9.3223 6.51818 5.35996 5.75809 9.2146 numMergedOcc 0
4 mol 48 unq 0 iso 0 dist 7.52915 5.41774 9.90229 3.60325 10.0585 8.29196 numMergedOcc 0
5 mol 62 unq 0 iso 0 dist 8.58588 7.30651 5.45648 6.13411 12.4786 8.93807 numMergedOcc 0
6 mol 79 unq 0 iso 0 dist 9.96175 8.57705 9.32786 8.65738 13.6524 8.18375 numMergedOcc 0
7 mol 79 unq 1 iso 0 dist 6.96066 7.58743 10.8503 5.73969 4.5892 9.21761 numMergedOcc 0
8 mol 81 unq 0 iso 0 dist 7.41802 8.38883 8.72274 5.82911 12.5514 8.96045 numMergedOcc 0
9 mol 98 unq 0 iso 0 dist 8.18252 6.0995 13.376 13.2035 20.1528 7.14813 numMergedOcc 0
10 mol 113 unq 0 iso 0 dist 9.15172 6.12348 13.6511 3.77247 12.8787 4.30875 numMergedOcc 0
11 mol 113 unq 1 iso 0 dist 9.15172 6.12348 13.6511 13.3539 21.9294 8.65807 numMergedOcc 0
12 mol 141 unq 0 iso 0 dist 8.53875 5.56446 9.00263 7.06015 13.5129 5.95801 numMergedOcc 0
13 mol 141 unq 1 iso 0 dist 8.53875 5.56446 9.00263 6 7.74168 9.92715 numMergedOcc 0
14 mol 186 unq 0 iso 0 dist 8.52322 6.52441 11.5572 12.7948 20.0335 9.34653 numMergedOcc 0
15 mol 192 unq 0 iso 0 dist 9.9224 7.93715 14.4241 9.20742 18.761 8.23162 numMergedOcc 0
16 mol 264 unq 0 iso 0 dist 6.43775 9.13546 8.52745 14.0586 16.3205 9.87744 numMergedOcc 0
17 mol 279 unq 0 iso 0 dist 7.35799 7.37488 4.1816 9.14234 7.72276 7.90632 numMergedOcc 0
18 mol 279 unq 1 iso 0 dist 7.67032 8.41945 5.03747 9.78358 5.16266 4.98693 numMergedOcc 0
