0 mol 4 unq 0 iso 0 dist 5.30385 11.0787 9.16617 11.7124 10.6506 8.24634 numMergedOcc 0
1 mol 4 unq 1 iso 0 dist 5.30385 11.0787 9.16617 11.6613 6.49264 8.87255 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 8.3964 14.959 8.4051 17.281 14.1082 8.23446 numMergedOcc 0
3 mol 24 unq 1 iso 0 dist 8.3964 14.959 8.4051 15.1953 9.62033 8.75662 numMergedOcc 0
4 mol 24 unq 2 iso 0 dist 8.3964 7.79468 7.29868 14.7675 10.2653 7.33768 numMergedOcc 0
5 mol 24 unq 3 iso 0 dist 8.3964 7.79468 7.29868 13.4394 6.16544 9.01567 numMergedOcc 0
6 mol 24 unq 4 iso 0 dist 8.3964 9.85198 8.60554 18.1292 14.1496 8.44664 numMergedOcc 0
7 mol 24 unq 5 iso 0 dist 8.3964 9.85198 8.60554 15.1953 9.62033 9.44691 numMergedOcc 0
8 mol 24 unq 6 iso 0 dist 7.06532 5.75653 8.23446 14.0475 14.1082 8.4051 numMergedOcc 0
9 mol 24 unq 7 iso 0 dist 7.06532 5.75653 8.23446 11.0714 11.342 8.75662 numMergedOcc 0
10 mol 65 unq 0 iso 0 dist 8.54555 10.2068 6.72639 7.0386 5.56801 9.34791 numMergedOcc 0
11 mol 65 unq 1 iso 0 dist 8.54555 5.38234 6.76508 7.0386 5.56801 8.22785 numMergedOcc 0
12 mol 65 unq 2 iso 0 dist 7.0386 10.2068 9.34791 8.54555 5.56801 6.72639 numMergedOcc 0
13 mol 65 unq 3 iso 0 dist 7.0386 5.38234 8.22785 8.54555 5.56801 6.76508 numMergedOcc 0
14 mol 91 unq 0 iso 0 dist 6.93893 14.4094 9.30539 15.4477 9.17687 9.01176 numMergedOcc 0
15 mol 92 unq 0 iso 0 dist 8.96747 6.09495 8.91313 10.6424 11.5449 8.16392 numMergedOcc 0
16 mol 92 unq 1 iso 0 dist 6.15654 5.1767 6.95572 7.89887 6.36037 7.38677 numMergedOcc 0
17 mol 92 unq 2 iso 0 dist 7.89887 5.1767 7.38677 6.15654 6.36037 6.95572 numMergedOcc 0
18 mol 125 unq 0 iso 0 dist 7.00113 5.759 8.76789 9.85979 4.38093 9.08382 numMergedOcc 0
19 mol 125 unq 1 iso 0 dist 7.00113 6.06241 7.73435 9.85979 4.38093 9.3778 numMergedOcc 0
20 mol 125 unq 2 iso 0 dist 9.85979 5.759 9.08382 7.00113 4.38093 8.76789 numMergedOcc 0
21 mol 125 unq 3 iso 0 dist 9.85979 6.06241 9.3778 7.00113 4.38093 7.73435 numMergedOcc 0
22 mol 129 unq 0 iso 0 dist 7.32407 5.99695 9.36851 6.48695 5.41583 4.97175 numMergedOcc 0
23 mol 129 unq 1 iso 0 dist 6.48695 5.99695 4.97175 7.32407 5.41583 9.36851 numMergedOcc 0
24 mol 148 unq 0 iso 0 dist 6.86997 9.70656 9.91993 7.46919 4.32771 6.22055 numMergedOcc 0
25 mol 148 unq 1 iso 0 dist 6.86997 5.77745 9.99156 7.46919 4.32771 8.18085 numMergedOcc 0
26 mol 148 unq 2 iso 0 dist 7.46919 9.70656 6.22055 6.86997 4.32771 9.91993 numMergedOcc 0
27 mol 148 unq 3 iso 0 dist 7.46919 5.77745 8.18085 6.86997 4.32771 9.99156 numMergedOcc 0
28 mol 150 unq 0 iso 0 dist 6.79381 9.69704 9.96691 7.36989 4.39943 6.14675 numMergedOcc 0
29 mol 150 unq 1 iso 0 dist 6.79381 9.69704 9.96691 8.17805 5.93611 9.24244 numMergedOcc 0
30 mol 150 unq 2 iso 0 dist 6.79381 5.71213 9.8656 7.36989 4.39943 7.94889 numMergedOcc 0
31 mol 150 unq 3 iso 0 dist 7.36989 9.69704 6.14675 6.79381 4.39943 9.96691 numMergedOcc 0
32 mol 150 unq 4 iso 0 dist 7.36989 9.69704 6.14675 8.17805 4.30207 9.24244 numMergedOcc 0
33 mol 150 unq 5 iso 0 dist 7.36989 5.71213 7.94889 6.79381 4.39943 9.8656 numMergedOcc 0
34 mol 150 unq 6 iso 0 dist 8.17805 9.69704 9.24244 6.79381 5.93611 9.96691 numMergedOcc 0
35 mol 150 unq 7 iso 0 dist 8.17805 9.69704 9.24244 7.36989 4.30207 6.14675 numMergedOcc 0
36 mol 171 unq 0 iso 0 dist 6.4751 9.28655 5.93786 5.75085 3.98338 8.1344 numMergedOcc 0
37 mol 171 unq 1 iso 0 dist 6.4751 10.4021 8.24693 5.75085 3.98338 6.71356 numMergedOcc 0
38 mol 171 unq 2 iso 0 dist 5.75085 9.28655 8.1344 6.4751 3.98338 5.93786 numMergedOcc 0
39 mol 171 unq 3 iso 0 dist 5.75085 10.4021 6.71356 6.4751 3.98338 8.24693 numMergedOcc 0
40 mol 174 unq 0 iso 0 dist 5.07761 12.6579 9.87122 9.23052 4.17687 8.87569 numMergedOcc 0
41 mol 188 unq 0 iso 0 dist 6.20426 9.41911 8.10214 13.2745 9.01338 7.14503 numMergedOcc 0
42 mol 194 unq 0 iso 0 dist 8.09776 10.977 6.72379 14.7117 6.7294 8.29382 numMergedOcc 0
43 mol 194 unq 1 iso 0 dist 6.57575 11.4562 6.72379 11.3191 6.7294 8.29382 numMergedOcc 0
44 mol 194 unq 2 iso 0 dist 9.30761 5.55582 6.72379 11.2528 6.7294 8.29382 numMergedOcc 0
45 mol 195 unq 0 iso 0 dist 9.25935 7.00308 7.36683 10.146 9.90317 6.95086 numMergedOcc 0
46 mol 197 unq 0 iso 0 dist 9.87211 8.58314 7.50013 6.3997 5.33623 5.81233 numMergedOcc 0
47 mol 197 unq 1 iso 0 dist 9.87211 8.58314 7.50013 14.5693 9.20574 6.92924 numMergedOcc 0
48 mol 197 unq 2 iso 0 dist 9.87211 8.58314 7.50013 14.557 10.8407 7.14306 numMergedOcc 0
49 mol 197 unq 3 iso 0 dist 6.3997 8.58314 5.81233 9.87211 5.33623 7.50013 numMergedOcc 0
50 mol 197 unq 4 iso 0 dist 6.3997 8.58314 5.81233 14.5693 11.2132 6.92924 numMergedOcc 0
51 mol 197 unq 5 iso 0 dist 6.3997 8.58314 5.81233 14.557 9.56047 7.14306 numMergedOcc 0
