0 mol 9 unq 0 iso 0 dist 9.8978 11.3797 9.62394 12.2544 4.45625 6.85412 8.77049 6.0397 6.33889 5.80437 numMergedOcc 0
1 mol 9 unq 0 iso 1 dist 9.8978 11.3797 9.62394 8.77049 6.0397 6.33889 12.2544 4.45625 6.85412 5.80437 numMergedOcc 0
2 mol 9 unq 1 iso 0 dist 6.26276 11.7623 9.62394 9.79973 4.45625 6.85412 6.95341 6.0397 6.33889 5.80437 numMergedOcc 0
3 mol 9 unq 1 iso 1 dist 6.26276 11.7623 9.62394 6.95341 6.0397 6.33889 9.79973 4.45625 6.85412 5.80437 numMergedOcc 0
4 mol 119 unq 0 iso 0 dist 9.34823 5.3154 6.73586 12.0315 4.95807 9.80862 10.2497 7.39626 8.43904 4.84196 numMergedOcc 0
5 mol 119 unq 0 iso 1 dist 9.34823 5.3154 6.73586 10.2497 7.39626 8.43904 12.0315 4.95807 9.80862 4.84196 numMergedOcc 0
6 mol 181 unq 0 iso 0 dist 5.66363 9.47799 8.90963 8.45395 4.43678 6.94688 5.41368 6.03415 6.71012 5.3528 numMergedOcc 0
7 mol 181 unq 0 iso 1 dist 5.66363 9.47799 8.90963 5.41368 6.03415 6.71012 8.45395 4.43678 6.94688 5.3528 numMergedOcc 0
8 mol 181 unq 1 iso 0 dist 5.97968 9.09989 8.90963 9.15368 4.43678 6.94688 7.96182 6.03415 6.71012 5.3528 numMergedOcc 0
9 mol 181 unq 1 iso 1 dist 5.97968 9.09989 8.90963 7.96182 6.03415 6.71012 9.15368 4.43678 6.94688 5.3528 numMergedOcc 0
10 mol 181 unq 2 iso 0 dist 8.50382 12.4243 8.90963 11.6365 4.43678 6.94688 13.0537 6.03415 6.71012 5.3528 numMergedOcc 0
11 mol 181 unq 2 iso 1 dist 8.50382 12.4243 8.90963 13.0537 6.03415 6.71012 11.6365 4.43678 6.94688 5.3528 numMergedOcc 0
12 mol 181 unq 3 iso 0 dist 8.63119 4.98009 8.90963 9.20477 4.43678 6.94688 7.90237 6.03415 6.71012 5.3528 numMergedOcc 0
13 mol 181 unq 3 iso 1 dist 8.63119 4.98009 8.90963 7.90237 6.03415 6.71012 9.20477 4.43678 6.94688 5.3528 numMergedOcc 0
14 mol 195 unq 0 iso 0 dist 8.80931 8.97729 9.26504 7.63511 4.4994 8.36117 11.3508 5.99784 6.77578 5.42587 numMergedOcc 0
15 mol 195 unq 0 iso 1 dist 8.80931 8.97729 9.26504 11.3508 5.99784 6.77578 7.63511 4.4994 8.36117 5.42587 numMergedOcc 0
16 mol 197 unq 0 iso 0 dist 7.40027 5.29309 6.92924 6.74777 4.59269 8.99696 13.021 11.3267 7.85058 14.5931 numMergedOcc 0
17 mol 197 unq 0 iso 1 dist 7.40027 5.29309 6.92924 13.021 11.3267 7.85058 6.74777 4.59269 8.99696 14.5931 numMergedOcc 0
18 mol 197 unq 1 iso 0 dist 7.40027 5.29309 6.92924 6.74777 4.59269 8.99696 12.0882 6.31157 9.96638 8.44549 numMergedOcc 0
19 mol 197 unq 1 iso 1 dist 7.40027 5.29309 6.92924 12.0882 6.31157 9.96638 6.74777 4.59269 8.99696 8.44549 numMergedOcc 0
20 mol 197 unq 1 iso 0 dist 7.40027 5.29309 6.92924 13.021 11.3267 7.85058 12.0882 6.31157 9.96638 10.0338 numMergedOcc 0
21 mol 197 unq 1 iso 1 dist 7.40027 5.29309 6.92924 12.0882 6.31157 9.96638 13.021 11.3267 7.85058 10.0338 numMergedOcc 0
22 mol 197 unq 2 iso 0 dist 8.98598 4.57437 7.50013 9.62514 11.1666 8.99696 10.7449 5.53129 7.85058 14.5931 numMergedOcc 0
23 mol 197 unq 2 iso 1 dist 8.98598 4.57437 7.50013 10.7449 5.53129 7.85058 9.62514 11.1666 8.99696 14.5931 numMergedOcc 0
24 mol 197 unq 3 iso 0 dist 8.98598 4.57437 7.50013 9.62514 11.1666 8.99696 12.2732 6.46195 9.96638 8.44549 numMergedOcc 0
25 mol 197 unq 3 iso 1 dist 8.98598 4.57437 7.50013 12.2732 6.46195 9.96638 9.62514 11.1666 8.99696 8.44549 numMergedOcc 0
26 mol 197 unq 3 iso 0 dist 8.98598 4.57437 7.50013 10.7449 5.53129 7.85058 12.2732 6.46195 9.96638 10.0338 numMergedOcc 0
27 mol 197 unq 3 iso 1 dist 8.98598 4.57437 7.50013 12.2732 6.46195 9.96638 10.7449 5.53129 7.85058 10.0338 numMergedOcc 0
28 mol 197 unq 4 iso 0 dist 7.06689 4.57437 5.81233 9.62514 13.3562 8.99696 10.7449 4.38296 7.85058 14.5931 numMergedOcc 0
29 mol 197 unq 4 iso 1 dist 7.06689 4.57437 5.81233 10.7449 4.38296 7.85058 9.62514 13.3562 8.99696 14.5931 numMergedOcc 0
30 mol 197 unq 5 iso 0 dist 7.06689 4.57437 5.81233 9.62514 13.3562 8.99696 12.2732 11.0356 9.96638 8.44549 numMergedOcc 0
31 mol 197 unq 5 iso 1 dist 7.06689 4.57437 5.81233 12.2732 11.0356 9.96638 9.62514 13.3562 8.99696 8.44549 numMergedOcc 0
32 mol 197 unq 5 iso 0 dist 7.06689 4.57437 5.81233 10.7449 4.38296 7.85058 12.2732 11.0356 9.96638 10.0338 numMergedOcc 0
33 mol 197 unq 5 iso 1 dist 7.06689 4.57437 5.81233 12.2732 11.0356 9.96638 10.7449 4.38296 7.85058 10.0338 numMergedOcc 0
34 mol 197 unq 6 iso 0 dist 9.69601 4.57437 6.92924 9.62514 4.59269 8.99696 10.7449 11.3267 7.85058 14.5931 numMergedOcc 0
35 mol 197 unq 6 iso 1 dist 9.69601 4.57437 6.92924 10.7449 11.3267 7.85058 9.62514 4.59269 8.99696 14.5931 numMergedOcc 0
36 mol 197 unq 7 iso 0 dist 9.69601 4.57437 6.92924 9.62514 4.59269 8.99696 12.2732 6.31157 9.96638 8.44549 numMergedOcc 0
37 mol 197 unq 7 iso 1 dist 9.69601 4.57437 6.92924 12.2732 6.31157 9.96638 9.62514 4.59269 8.99696 8.44549 numMergedOcc 0
38 mol 197 unq 7 iso 0 dist 9.69601 4.57437 6.92924 10.7449 11.3267 7.85058 12.2732 6.31157 9.96638 10.0338 numMergedOcc 0
39 mol 197 unq 7 iso 1 dist 9.69601 4.57437 6.92924 12.2732 6.31157 9.96638 10.7449 11.3267 7.85058 10.0338 numMergedOcc 0
40 mol 238 unq 0 iso 0 dist 7.26887 6.57364 7.02333 10.6477 4.38002 8.14172 10.1469 11.5793 8.09066 10.9258 numMergedOcc 0
41 mol 238 unq 0 iso 1 dist 7.26887 6.57364 7.02333 10.1469 11.5793 8.09066 10.6477 4.38002 8.14172 10.9258 numMergedOcc 0
42 mol 238 unq 1 iso 0 dist 7.26887 10.9854 8.67864 10.6477 4.38002 6.77463 10.1469 11.5793 7.2766 10.9258 numMergedOcc 0
43 mol 238 unq 1 iso 1 dist 7.26887 10.9854 8.67864 10.1469 11.5793 7.2766 10.6477 4.38002 6.77463 10.9258 numMergedOcc 0
44 mol 264 unq 0 iso 0 dist 9.3201 3.93713 7.16853 11.0809 9.76317 9.0012 11.1852 13.9064 9.5784 6.20393 numMergedOcc 0
45 mol 264 unq 0 iso 1 dist 9.3201 3.93713 7.16853 11.1852 13.9064 9.5784 11.0809 9.76317 9.0012 6.20393 numMergedOcc 0
46 mol 287 unq 0 iso 0 dist 8.42076 8.60619 6.89451 11.7204 4.481 7.04472 11.8006 12.237 6.4778 11.01 numMergedOcc 0
47 mol 287 unq 0 iso 1 dist 8.42076 8.60619 6.89451 11.8006 12.237 6.4778 11.7204 4.481 7.04472 11.01 numMergedOcc 0
48 mol 288 unq 0 iso 0 dist 8.42076 8.60619 6.89451 11.7204 4.481 7.04472 11.8006 12.237 6.4778 11.01 numMergedOcc 0
49 mol 288 unq 0 iso 1 dist 8.42076 8.60619 6.89451 11.8006 12.237 6.4778 11.7204 4.481 7.04472 11.01 numMergedOcc 0
50 mol 289 unq 0 iso 0 dist 8.42076 8.60619 6.89451 11.7204 4.481 7.04472 11.8006 12.237 6.4778 11.01 numMergedOcc 0
51 mol 289 unq 0 iso 1 dist 8.42076 8.60619 6.89451 11.8006 12.237 6.4778 11.7204 4.481 7.04472 11.01 numMergedOcc 0
