0 mol 48 unq 0 iso 0 dist 8.36915 5.43913 5.44336 8.26877 10.4965 5.62671 numMergedOcc 0
1 mol 48 unq 0 iso 1 dist 8.36915 8.26877 10.4965 5.43913 5.44336 5.62671 numMergedOcc 0
2 mol 48 unq 1 iso 0 dist 6.01454 5.43913 9.12054 8.26877 13.688 5.62671 numMergedOcc 0
3 mol 48 unq 1 iso 1 dist 6.01454 8.26877 13.688 5.43913 9.12054 5.62671 numMergedOcc 0
4 mol 79 unq 0 iso 0 dist 7.41952 6.65972 8.14479 4.2253 9.07516 5.63083 numMergedOcc 0
5 mol 79 unq 0 iso 1 dist 7.41952 4.2253 9.07516 6.65972 8.14479 5.63083 numMergedOcc 0
6 mol 129 unq 0 iso 0 dist 7.07421 4.4077 6.14663 8.4874 5.32811 5.83342 numMergedOcc 0
7 mol 129 unq 0 iso 1 dist 7.07421 8.4874 5.32811 4.4077 6.14663 5.83342 numMergedOcc 0
8 mol 162 unq 0 iso 0 dist 8.98459 9.88912 4.06355 9.46218 11.8004 12.6144 numMergedOcc 0
9 mol 162 unq 0 iso 1 dist 8.98459 9.46218 11.8004 9.88912 4.06355 12.6144 numMergedOcc 0
10 mol 165 unq 0 iso 0 dist 9.59989 9.98689 9.80262 5.93144 11.7431 15.5252 numMergedOcc 0
11 mol 165 unq 0 iso 1 dist 9.59989 5.93144 11.7431 9.98689 9.80262 15.5252 numMergedOcc 0
12 mol 186 unq 0 iso 0 dist 8.39345 6.97766 4.25519 4.79423 6.35206 6.13455 numMergedOcc 0
13 mol 186 unq 0 iso 1 dist 8.39345 4.79423 6.35206 6.97766 4.25519 6.13455 numMergedOcc 0
14 mol 204 unq 0 iso 0 dist 7.00683 9.41594 4.96901 9.92651 3.72258 4.97009 numMergedOcc 0
15 mol 204 unq 0 iso 1 dist 7.00683 9.92651 3.72258 9.41594 4.96901 4.97009 numMergedOcc 0
16 mol 207 unq 0 iso 0 dist 8.84785 5.77532 5.88434 8.75785 8.75857 5.27291 numMergedOcc 0
17 mol 207 unq 0 iso 1 dist 8.84785 8.75785 8.75857 5.77532 5.88434 5.27291 numMergedOcc 0
18 mol 238 unq 0 iso 0 dist 6.74214 8.62485 6.17041 9.37688 3.90516 3.92744 numMergedOcc 0
19 mol 238 unq 0 iso 1 dist 6.74214 9.37688 3.90516 8.62485 6.17041 3.92744 numMergedOcc 0
20 mol 238 unq 1 iso 0 dist 5.33462 8.62485 4.51854 9.37688 5.3726 3.92744 numMergedOcc 0
21 mol 238 unq 1 iso 1 dist 5.33462 9.37688 5.3726 8.62485 4.51854 3.92744 numMergedOcc 0
22 mol 253 unq 0 iso 0 dist 9.58767 9.31626 7.64377 9.77366 4.87368 3.10832 numMergedOcc 0
23 mol 253 unq 0 iso 1 dist 9.58767 9.77366 4.87368 9.31626 7.64377 3.10832 numMergedOcc 0
24 mol 254 unq 0 iso 0 dist 9.36171 7.02613 7.04725 8.95185 13.2196 13.3862 numMergedOcc 0
25 mol 254 unq 0 iso 1 dist 9.36171 8.95185 13.2196 7.02613 7.04725 13.3862 numMergedOcc 0
26 mol 254 unq 1 iso 0 dist 7.53352 8.30975 9.97794 8.10036 9.08435 4.12416 numMergedOcc 0
27 mol 254 unq 1 iso 1 dist 7.53352 8.10036 9.08435 8.30975 9.97794 4.12416 numMergedOcc 0
28 mol 254 unq 2 iso 0 dist 7.53352 8.30975 9.97794 8.96529 13.2196 14.2091 numMergedOcc 0
29 mol 254 unq 2 iso 1 dist 7.53352 8.96529 13.2196 8.30975 9.97794 14.2091 numMergedOcc 0
30 mol 254 unq 2 iso 0 dist 7.53352 8.10036 9.08435 8.96529 13.2196 11.5654 numMergedOcc 0
31 mol 254 unq 2 iso 1 dist 7.53352 8.96529 13.2196 8.10036 9.08435 11.5654 numMergedOcc 0
32 mol 254 unq 3 iso 0 dist 7.87218 7.02613 3.99032 8.95185 11.5993 13.3862 numMergedOcc 0
33 mol 254 unq 3 iso 1 dist 7.87218 8.95185 11.5993 7.02613 3.99032 13.3862 numMergedOcc 0
34 mol 254 unq 4 iso 0 dist 7.80793 8.30975 4.69026 8.10036 4.10825 4.12416 numMergedOcc 0
35 mol 254 unq 4 iso 1 dist 7.80793 8.10036 4.10825 8.30975 4.69026 4.12416 numMergedOcc 0
36 mol 254 unq 5 iso 0 dist 7.80793 8.30975 4.69026 8.96529 13.4679 14.2091 numMergedOcc 0
37 mol 254 unq 5 iso 1 dist 7.80793 8.96529 13.4679 8.30975 4.69026 14.2091 numMergedOcc 0
38 mol 254 unq 5 iso 0 dist 7.80793 8.10036 4.10825 8.96529 13.4679 11.5654 numMergedOcc 0
39 mol 254 unq 5 iso 1 dist 7.80793 8.96529 13.4679 8.10036 4.10825 11.5654 numMergedOcc 0
40 mol 266 unq 0 iso 0 dist 6.91743 9.80672 3.60985 9.26882 5.9856 4.24347 numMergedOcc 0
41 mol 266 unq 0 iso 1 dist 6.91743 9.26882 5.9856 9.80672 3.60985 4.24347 numMergedOcc 0
42 mol 266 unq 1 iso 0 dist 6.91743 9.80672 3.60985 9.38539 4.90674 3.66295 numMergedOcc 0
43 mol 266 unq 1 iso 1 dist 6.91743 9.38539 4.90674 9.80672 3.60985 3.66295 numMergedOcc 0
44 mol 266 unq 1 iso 0 dist 6.91743 9.26882 5.9856 9.38539 4.90674 3.37902 numMergedOcc 0
45 mol 266 unq 1 iso 1 dist 6.91743 9.38539 4.90674 9.26882 5.9856 3.37902 numMergedOcc 0
46 mol 285 unq 0 iso 0 dist 8.63954 6.07843 10.0892 9.66678 16.8309 7.33055 numMergedOcc 0
47 mol 285 unq 0 iso 1 dist 8.63954 9.66678 16.8309 6.07843 10.0892 7.33055 numMergedOcc 0
48 mol 285 unq 1 iso 0 dist 4.74716 6.07843 3.97296 9.66678 10.6606 7.33055 numMergedOcc 0
49 mol 285 unq 1 iso 1 dist 4.74716 9.66678 10.6606 6.07843 3.97296 7.33055 numMergedOcc 0
