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2 mol 7 unq 1 iso 0 dist 5.72491 12.2041 7.88043 10.515 7.45262 6.06176 numMergedOcc 0
3 mol 7 unq 1 iso 1 dist 7.88043 12.2041 5.72491 6.06176 7.45262 10.515 numMergedOcc 0
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5 mol 8 unq 0 iso 1 dist 6.24978 6.94408 6.82379 10.6893 8.94096 13.7792 numMergedOcc 0
6 mol 8 unq 1 iso 0 dist 6.82379 6.94408 6.24978 15.4959 9.07858 12.0818 numMergedOcc 0
7 mol 8 unq 1 iso 1 dist 6.24978 6.94408 6.82379 12.0818 9.07858 15.4959 numMergedOcc 0
8 mol 8 unq 2 iso 0 dist 6.82379 11.2508 9.66439 13.7792 8.94096 13.8882 numMergedOcc 0
9 mol 8 unq 2 iso 1 dist 9.66439 11.2508 6.82379 13.8882 8.94096 13.7792 numMergedOcc 0
10 mol 8 unq 3 iso 0 dist 6.82379 11.2508 9.66439 15.4959 9.07858 11.4738 numMergedOcc 0
11 mol 8 unq 3 iso 1 dist 9.66439 11.2508 6.82379 11.4738 9.07858 15.4959 numMergedOcc 0
12 mol 8 unq 4 iso 0 dist 6.82379 12.4076 7.3915 13.7792 8.94096 12.8924 numMergedOcc 0
13 mol 8 unq 4 iso 1 dist 7.3915 12.4076 6.82379 12.8924 8.94096 13.7792 numMergedOcc 0
14 mol 8 unq 5 iso 0 dist 6.82379 12.4076 7.3915 15.4959 9.07858 4.85329 numMergedOcc 0
15 mol 8 unq 5 iso 1 dist 7.3915 12.4076 6.82379 4.85329 9.07858 15.4959 numMergedOcc 0
16 mol 8 unq 2 iso 0 dist 6.24978 5.3787 9.66439 10.6893 8.94096 13.8882 numMergedOcc 0
17 mol 8 unq 2 iso 1 dist 9.66439 5.3787 6.24978 13.8882 8.94096 10.6893 numMergedOcc 0
18 mol 8 unq 3 iso 0 dist 6.24978 5.3787 9.66439 12.0818 9.07858 11.4738 numMergedOcc 0
19 mol 8 unq 3 iso 1 dist 9.66439 5.3787 6.24978 11.4738 9.07858 12.0818 numMergedOcc 0
20 mol 8 unq 4 iso 0 dist 6.24978 9.22548 7.3915 10.6893 8.94096 12.8924 numMergedOcc 0
21 mol 8 unq 4 iso 1 dist 7.3915 9.22548 6.24978 12.8924 8.94096 10.6893 numMergedOcc 0
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23 mol 8 unq 5 iso 1 dist 7.3915 9.22548 6.24978 4.85329 9.07858 12.0818 numMergedOcc 0
24 mol 8 unq 4 iso 0 dist 9.66439 7.96511 7.3915 13.8882 8.94096 12.8924 numMergedOcc 0
25 mol 8 unq 4 iso 1 dist 7.3915 7.96511 9.66439 12.8924 8.94096 13.8882 numMergedOcc 0
26 mol 8 unq 5 iso 0 dist 9.66439 7.96511 7.3915 11.4738 9.07858 4.85329 numMergedOcc 0
27 mol 8 unq 5 iso 1 dist 7.3915 7.96511 9.66439 4.85329 9.07858 11.4738 numMergedOcc 0
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29 mol 13 unq 0 iso 1 dist 6.26071 5.94592 5.78148 10.5634 8.00865 13.1699 numMergedOcc 0
30 mol 13 unq 1 iso 0 dist 5.78148 5.94592 6.26071 11.1987 9.11447 12.0488 numMergedOcc 0
31 mol 13 unq 1 iso 1 dist 6.26071 5.94592 5.78148 12.0488 9.11447 11.1987 numMergedOcc 0
32 mol 13 unq 2 iso 0 dist 5.78148 10.8906 8.43325 13.1699 8.00865 8.66829 numMergedOcc 0
33 mol 13 unq 2 iso 1 dist 8.43325 10.8906 5.78148 8.66829 8.00865 13.1699 numMergedOcc 0
34 mol 13 unq 3 iso 0 dist 5.78148 10.8906 8.43325 11.1987 9.11447 14.2112 numMergedOcc 0
35 mol 13 unq 3 iso 1 dist 8.43325 10.8906 5.78148 14.2112 9.11447 11.1987 numMergedOcc 0
36 mol 13 unq 2 iso 0 dist 6.26071 5.43688 8.43325 10.5634 8.00865 8.66829 numMergedOcc 0
37 mol 13 unq 2 iso 1 dist 8.43325 5.43688 6.26071 8.66829 8.00865 10.5634 numMergedOcc 0
38 mol 13 unq 3 iso 0 dist 6.26071 5.43688 8.43325 12.0488 9.11447 14.2112 numMergedOcc 0
39 mol 13 unq 3 iso 1 dist 8.43325 5.43688 6.26071 14.2112 9.11447 12.0488 numMergedOcc 0
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43 mol 24 unq 0 iso 1 dist 7.83786 7.05502 6.60423 4.51549 8.62284 5.39241 numMergedOcc 0
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191 mol 279 unq 0 iso 1 dist 6.43341 6.67478 8.29305 7.18967 8.23056 5.3373 numMergedOcc 0
