0 mol 7 unq 0 iso 0 dist 7.32392 10.5949 6.7985 10.1204 9.0379 9.68596 5.14168 10.25 10.1841 9.87885 numMergedOcc 0
1 mol 8 unq 0 iso 0 dist 4.92734 7.97177 8.53529 13.8619 12.4076 7.03958 11.5556 12.536 4.1204 6.56356 numMergedOcc 0
2 mol 8 unq 1 iso 0 dist 4.92734 7.97177 8.53529 6.57999 8.4069 7.18019 11.5556 12.536 4.1204 9.01112 numMergedOcc 0
3 mol 8 unq 2 iso 0 dist 4.92734 7.97177 8.53529 12.3088 12.9016 8.44009 11.5556 12.536 4.1204 7.62333 numMergedOcc 0
4 mol 8 unq 3 iso 0 dist 6.4754 5.3298 7.18019 10.2567 10.9495 7.03958 4.67793 9.01112 4.1204 6.56356 numMergedOcc 0
5 mol 8 unq 4 iso 0 dist 6.4754 5.3298 7.18019 7.3795 6.23795 8.44009 4.67793 9.01112 4.1204 7.62333 numMergedOcc 0
6 mol 8 unq 5 iso 0 dist 6.57999 7.97177 7.18019 13.8619 10.9495 7.03958 11.5556 9.01112 4.1204 6.56356 numMergedOcc 0
7 mol 8 unq 6 iso 0 dist 6.57999 7.97177 7.18019 12.3088 6.23795 8.44009 11.5556 9.01112 4.1204 7.62333 numMergedOcc 0
8 mol 8 unq 7 iso 0 dist 7.3795 5.3298 8.44009 10.2567 8.09332 7.03958 4.67793 7.62333 4.1204 6.56356 numMergedOcc 0
9 mol 8 unq 8 iso 0 dist 7.3795 5.3298 8.44009 6.4754 6.23795 7.18019 4.67793 7.62333 4.1204 9.01112 numMergedOcc 0
10 mol 25 unq 0 iso 0 dist 6.23095 12.1434 8.6653 11.9439 10.6808 7.92503 10.0811 11.4732 11.0175 4.79873 numMergedOcc 0
11 mol 25 unq 1 iso 0 dist 6.23095 12.1434 8.6653 11.9439 10.6808 7.92503 19.7487 17.8732 10.2758 9.48085 numMergedOcc 0
12 mol 25 unq 2 iso 0 dist 9.22151 6.63966 8.50222 14.305 15.5644 8.87757 7.3252 10.9703 3.904 7.05196 numMergedOcc 0
13 mol 25 unq 3 iso 0 dist 6.22122 6.63966 7.55264 14.305 16.1048 8.87757 7.3252 10.3338 3.904 7.05196 numMergedOcc 0
14 mol 30 unq 0 iso 0 dist 9.28932 5.2347 7.12365 6.83481 5.34368 8.1284 6.01658 6.07517 4.98558 6.74179 numMergedOcc 0
15 mol 30 unq 1 iso 0 dist 7.53042 5.9029 7.12365 11.534 5.34368 8.1284 8.34136 6.07517 4.98558 6.74179 numMergedOcc 0
16 mol 30 unq 2 iso 0 dist 6.83481 5.2347 8.1284 9.28932 5.34368 7.12365 6.01658 6.74179 4.98558 6.07517 numMergedOcc 0
17 mol 98 unq 0 iso 0 dist 5.85841 4.81103 5.78706 11.1652 7.51619 7.23884 14.465 11.2061 12.82 9.64383 numMergedOcc 0
18 mol 98 unq 1 iso 0 dist 6.78839 7.22196 5.78706 11.1321 7.51619 7.23884 10.3972 11.2061 12.82 9.64383 numMergedOcc 0
19 mol 98 unq 2 iso 0 dist 7.00285 4.81103 5.59328 11.1652 11.4338 7.23884 14.465 14.7009 12.82 9.64383 numMergedOcc 0
20 mol 98 unq 3 iso 0 dist 8.02354 7.22196 5.59328 11.1321 11.4338 7.23884 10.3972 14.7009 12.82 9.64383 numMergedOcc 0
21 mol 119 unq 0 iso 0 dist 8.62648 9.25614 6.52773 11.5266 4.85907 9.11344 12.6962 7.64052 5.37917 6.99446 numMergedOcc 0
22 mol 181 unq 0 iso 0 dist 8.90247 6.56225 6.2479 6.58792 6.01247 6.22122 11.9701 9.76212 6.39406 8.59874 numMergedOcc 0
23 mol 181 unq 1 iso 0 dist 6.58792 6.56225 6.22122 8.90247 6.01247 6.2479 11.9701 8.59874 6.39406 9.76212 numMergedOcc 0
24 mol 195 unq 0 iso 0 dist 8.3705 11.3703 9.26504 15.8199 10.7531 7.36683 18.1302 16.1768 8.90504 7.41662 numMergedOcc 0
25 mol 213 unq 0 iso 0 dist 9.75141 10.9044 8.14332 13.93 5.45334 7.73322 18.8234 12.9743 8.99471 8.21793 numMergedOcc 0
26 mol 238 unq 0 iso 0 dist 5.67917 5.11183 7.57812 12.6253 10.0191 9.24557 18.6558 14.4013 17.1065 9.72188 numMergedOcc 0
