0 mol 4 unq 0 iso 0 dist 8.19615 5.93215 8.24634 11.0393 9.16617 10.6506 numMergedOcc 0
1 mol 4 unq 0 iso 1 dist 8.19615 11.0393 9.16617 5.93215 8.24634 10.6506 numMergedOcc 0
2 mol 4 unq 1 iso 0 dist 8.19615 5.93215 8.24634 8.61594 8.87255 11.7391 numMergedOcc 0
3 mol 4 unq 1 iso 1 dist 8.19615 8.61594 8.87255 5.93215 8.24634 11.7391 numMergedOcc 0
4 mol 4 unq 1 iso 0 dist 8.19615 11.0393 9.16617 8.61594 8.87255 6.49264 numMergedOcc 0
5 mol 4 unq 1 iso 1 dist 8.19615 8.61594 8.87255 11.0393 9.16617 6.49264 numMergedOcc 0
6 mol 65 unq 0 iso 0 dist 9.9997 8.24043 6.72639 11.819 9.34791 5.56801 numMergedOcc 0
7 mol 65 unq 0 iso 1 dist 9.9997 11.819 9.34791 8.24043 6.72639 5.56801 numMergedOcc 0
8 mol 65 unq 1 iso 0 dist 9.38611 4.91428 6.76508 7.66509 8.22785 5.56801 numMergedOcc 0
9 mol 65 unq 1 iso 1 dist 9.38611 7.66509 8.22785 4.91428 6.76508 5.56801 numMergedOcc 0
10 mol 91 unq 0 iso 0 dist 7.47827 3.98211 9.30539 6.76611 9.01176 9.17687 numMergedOcc 0
11 mol 91 unq 0 iso 1 dist 7.47827 6.76611 9.01176 3.98211 9.30539 9.17687 numMergedOcc 0
12 mol 92 unq 0 iso 0 dist 5.89394 10.9738 6.95572 10.3703 7.38677 6.36037 numMergedOcc 0
13 mol 92 unq 0 iso 1 dist 5.89394 10.3703 7.38677 10.9738 6.95572 6.36037 numMergedOcc 0
14 mol 109 unq 0 iso 0 dist 8.91837 10.5258 7.02927 5.61989 6.60933 10.6137 numMergedOcc 0
15 mol 109 unq 0 iso 1 dist 8.91837 5.61989 6.60933 10.5258 7.02927 10.6137 numMergedOcc 0
16 mol 117 unq 0 iso 0 dist 8.76613 5.45718 7.70232 6.25846 7.4671 4.04941 numMergedOcc 0
17 mol 117 unq 0 iso 1 dist 8.76613 6.25846 7.4671 5.45718 7.70232 4.04941 numMergedOcc 0
18 mol 119 unq 0 iso 0 dist 8.59784 8.66162 6.52773 6.71925 9.23858 12.3703 numMergedOcc 0
19 mol 119 unq 0 iso 1 dist 8.59784 6.71925 9.23858 8.66162 6.52773 12.3703 numMergedOcc 0
20 mol 122 unq 0 iso 0 dist 5.09114 9.32745 8.88537 10.5529 9.23819 5.03547 numMergedOcc 0
21 mol 122 unq 0 iso 1 dist 5.09114 10.5529 9.23819 9.32745 8.88537 5.03547 numMergedOcc 0
22 mol 125 unq 0 iso 0 dist 8.38646 6.24872 7.73435 10.4668 9.3778 4.38093 numMergedOcc 0
23 mol 125 unq 0 iso 1 dist 8.38646 10.4668 9.3778 6.24872 7.73435 4.38093 numMergedOcc 0
24 mol 129 unq 0 iso 0 dist 8.14071 9.81728 9.36851 6.95825 4.97175 5.41583 numMergedOcc 0
25 mol 129 unq 0 iso 1 dist 8.14071 6.95825 4.97175 9.81728 9.36851 5.41583 numMergedOcc 0
26 mol 143 unq 0 iso 0 dist 8.72463 16.1752 7.78652 17.1567 8.91301 4.30566 numMergedOcc 0
27 mol 143 unq 0 iso 1 dist 8.72463 17.1567 8.91301 16.1752 7.78652 4.30566 numMergedOcc 0
28 mol 148 unq 0 iso 0 dist 9.7168 6.57631 9.99156 8.40891 8.18085 4.32771 numMergedOcc 0
29 mol 148 unq 0 iso 1 dist 9.7168 8.40891 8.18085 6.57631 9.99156 4.32771 numMergedOcc 0
30 mol 150 unq 0 iso 0 dist 9.61132 6.56068 9.8656 8.32178 7.94889 4.39943 numMergedOcc 0
31 mol 150 unq 0 iso 1 dist 9.61132 8.32178 7.94889 6.56068 9.8656 4.39943 numMergedOcc 0
32 mol 156 unq 0 iso 0 dist 7.80643 11.7605 9.44367 5.95655 9.47433 16.7026 numMergedOcc 0
33 mol 156 unq 0 iso 1 dist 7.80643 5.95655 9.47433 11.7605 9.44367 16.7026 numMergedOcc 0
34 mol 159 unq 0 iso 0 dist 7.78695 9.00075 9.17787 11.6088 8.4858 7.73341 numMergedOcc 0
35 mol 159 unq 0 iso 1 dist 7.78695 11.6088 8.4858 9.00075 9.17787 7.73341 numMergedOcc 0
36 mol 181 unq 0 iso 0 dist 6.07676 6.28923 6.46704 6.10683 6.59025 9.87773 numMergedOcc 0
37 mol 181 unq 0 iso 1 dist 6.07676 6.10683 6.59025 6.28923 6.46704 9.87773 numMergedOcc 0
38 mol 181 unq 1 iso 0 dist 6.96824 4.75774 5.9176 9.91956 6.41453 9.53592 numMergedOcc 0
39 mol 181 unq 1 iso 1 dist 6.96824 9.91956 6.41453 4.75774 5.9176 9.53592 numMergedOcc 0
40 mol 182 unq 0 iso 0 dist 6.31492 7.00671 6.73956 11.1247 7.09394 6.27728 numMergedOcc 0
41 mol 182 unq 0 iso 1 dist 6.31492 11.1247 7.09394 7.00671 6.73956 6.27728 numMergedOcc 0
42 mol 182 unq 1 iso 0 dist 7.8621 9.23913 6.73956 5.77163 7.09394 6.27728 numMergedOcc 0
43 mol 182 unq 1 iso 1 dist 7.8621 5.77163 7.09394 9.23913 6.73956 6.27728 numMergedOcc 0
44 mol 213 unq 0 iso 0 dist 6.82185 10.6201 7.37798 5.50169 7.73322 13.2902 numMergedOcc 0
45 mol 213 unq 0 iso 1 dist 6.82185 5.50169 7.73322 10.6201 7.37798 13.2902 numMergedOcc 0
46 mol 238 unq 0 iso 0 dist 7.2527 10.0472 7.57812 10.0651 8.69104 6.25098 numMergedOcc 0
47 mol 238 unq 0 iso 1 dist 7.2527 10.0651 8.69104 10.0472 7.57812 6.25098 numMergedOcc 0
48 mol 238 unq 1 iso 0 dist 9.29203 13.6806 7.57812 16.2617 8.69104 6.25098 numMergedOcc 0
49 mol 238 unq 1 iso 1 dist 9.29203 16.2617 8.69104 13.6806 7.57812 6.25098 numMergedOcc 0
