0 mol 9 unq 0 iso 0 dist 9.8978 11.3797 9.62394 12.8762 9.5997 8.57077 12.2544 4.45625 6.85412 8.27962 numMergedOcc 0
1 mol 9 unq 1 iso 0 dist 9.8978 11.3797 9.62394 12.8762 9.5997 8.57077 8.77049 6.0397 6.33889 11.4878 numMergedOcc 0
2 mol 9 unq 2 iso 0 dist 6.26276 11.7623 9.62394 13.0231 9.5997 8.57077 9.79973 4.45625 6.85412 8.27962 numMergedOcc 0
3 mol 9 unq 3 iso 0 dist 6.26276 11.7623 9.62394 13.0231 9.5997 8.57077 6.95341 6.0397 6.33889 11.4878 numMergedOcc 0
4 mol 15 unq 0 iso 0 dist 5.19544 7.63656 7.07399 8.72187 4.29582 8.38064 6.61158 6.33828 8.21493 5.90976 numMergedOcc 0
5 mol 25 unq 0 iso 0 dist 7.05148 6.17631 8.6653 9.87281 5.64303 7.31767 13.4756 12.9735 7.685 8.43188 numMergedOcc 0
6 mol 25 unq 1 iso 0 dist 7.05148 6.17631 8.6653 7.63928 5.82503 6.03987 13.4756 12.9735 7.685 10.3635 numMergedOcc 0
7 mol 58 unq 0 iso 0 dist 5.84625 5.40367 8.80614 9.01612 10.2049 6.86465 11.074 8.88332 9.58673 5.92889 numMergedOcc 0
8 mol 58 unq 1 iso 0 dist 5.84625 5.40367 8.80614 6.36193 9.95364 6.62496 11.074 8.88332 9.58673 10.2241 numMergedOcc 0
9 mol 58 unq 2 iso 0 dist 5.84625 5.40367 8.80614 4.88613 5.49591 6.35756 11.074 8.88332 9.58673 7.05413 numMergedOcc 0
10 mol 114 unq 0 iso 0 dist 8.96382 8.14567 6.84011 12.7833 7.436 7.5732 10.2829 9.23527 8.71128 5.80557 numMergedOcc 0
11 mol 119 unq 0 iso 0 dist 9.34823 5.3154 6.73586 6.18763 5.13589 6.18601 12.0315 4.95807 9.80862 9.35964 numMergedOcc 0
12 mol 119 unq 1 iso 0 dist 9.34823 5.3154 6.73586 6.18763 5.13589 6.18601 10.2497 7.39626 8.43904 10.3457 numMergedOcc 0
13 mol 167 unq 0 iso 0 dist 9.14629 7.91498 9.67741 16.5098 13.0123 9.87651 12.2649 7.31643 8.62646 6.58937 numMergedOcc 0
14 mol 181 unq 0 iso 0 dist 5.66363 9.47799 8.90963 9.86845 8.91338 9.1374 8.45395 4.43678 6.94688 6.25083 numMergedOcc 0
15 mol 181 unq 1 iso 0 dist 5.66363 9.47799 8.90963 9.86845 8.91338 9.1374 5.41368 6.03415 6.71012 4.77278 numMergedOcc 0
16 mol 181 unq 2 iso 0 dist 5.66363 9.47799 8.90963 13.0329 9.81073 5.98885 8.45395 4.43678 6.94688 5.86342 numMergedOcc 0
17 mol 181 unq 3 iso 0 dist 5.66363 9.47799 8.90963 13.0329 9.81073 5.98885 5.41368 6.03415 6.71012 9.14057 numMergedOcc 0
18 mol 181 unq 4 iso 0 dist 5.66363 9.47799 8.90963 14.039 9.34211 9.15386 8.45395 4.43678 6.94688 6.80228 numMergedOcc 0
19 mol 181 unq 5 iso 0 dist 5.66363 9.47799 8.90963 14.039 9.34211 9.15386 5.41368 6.03415 6.71012 11.6919 numMergedOcc 0
20 mol 181 unq 6 iso 0 dist 5.97968 9.09989 8.90963 12.5284 8.91338 9.1374 9.15368 4.43678 6.94688 6.25083 numMergedOcc 0
21 mol 181 unq 7 iso 0 dist 5.97968 9.09989 8.90963 12.5284 8.91338 9.1374 7.96182 6.03415 6.71012 4.77278 numMergedOcc 0
22 mol 181 unq 8 iso 0 dist 5.97968 9.09989 8.90963 12.9014 9.81073 5.98885 9.15368 4.43678 6.94688 5.86342 numMergedOcc 0
23 mol 181 unq 9 iso 0 dist 5.97968 9.09989 8.90963 12.9014 9.81073 5.98885 7.96182 6.03415 6.71012 9.14057 numMergedOcc 0
24 mol 181 unq 10 iso 0 dist 5.97968 9.09989 8.90963 12.9138 9.34211 9.15386 9.15368 4.43678 6.94688 6.80228 numMergedOcc 0
25 mol 181 unq 11 iso 0 dist 5.97968 9.09989 8.90963 12.9138 9.34211 9.15386 7.96182 6.03415 6.71012 11.6919 numMergedOcc 0
26 mol 181 unq 12 iso 0 dist 8.50382 12.4243 8.90963 16.91 8.91338 9.1374 11.6365 4.43678 6.94688 6.25083 numMergedOcc 0
27 mol 181 unq 13 iso 0 dist 8.50382 12.4243 8.90963 16.91 8.91338 9.1374 13.0537 6.03415 6.71012 4.77278 numMergedOcc 0
28 mol 181 unq 14 iso 0 dist 8.50382 12.4243 8.90963 14.5608 9.81073 5.98885 11.6365 4.43678 6.94688 5.86342 numMergedOcc 0
29 mol 181 unq 15 iso 0 dist 8.50382 12.4243 8.90963 14.5608 9.81073 5.98885 13.0537 6.03415 6.71012 9.14057 numMergedOcc 0
30 mol 181 unq 16 iso 0 dist 8.50382 12.4243 8.90963 12.2786 9.34211 9.15386 11.6365 4.43678 6.94688 6.80228 numMergedOcc 0
31 mol 181 unq 17 iso 0 dist 8.50382 12.4243 8.90963 12.2786 9.34211 9.15386 13.0537 6.03415 6.71012 11.6919 numMergedOcc 0
32 mol 181 unq 18 iso 0 dist 8.63119 4.98009 8.90963 12.0593 8.91338 9.1374 9.20477 4.43678 6.94688 6.25083 numMergedOcc 0
33 mol 181 unq 19 iso 0 dist 8.63119 4.98009 8.90963 12.0593 8.91338 9.1374 7.90237 6.03415 6.71012 4.77278 numMergedOcc 0
34 mol 181 unq 20 iso 0 dist 8.63119 4.98009 8.90963 10.3248 9.81073 5.98885 9.20477 4.43678 6.94688 5.86342 numMergedOcc 0
35 mol 181 unq 21 iso 0 dist 8.63119 4.98009 8.90963 10.3248 9.81073 5.98885 7.90237 6.03415 6.71012 9.14057 numMergedOcc 0
36 mol 181 unq 22 iso 0 dist 8.63119 4.98009 8.90963 11.7479 9.34211 9.15386 9.20477 4.43678 6.94688 6.80228 numMergedOcc 0
37 mol 181 unq 23 iso 0 dist 8.63119 4.98009 8.90963 11.7479 9.34211 9.15386 7.90237 6.03415 6.71012 11.6919 numMergedOcc 0
38 mol 181 unq 24 iso 0 dist 9.07527 9.32503 5.9176 12.06 5.63555 7.63312 13.9657 5.60306 6.93764 4.80231 numMergedOcc 0
39 mol 197 unq 0 iso 0 dist 7.40027 5.29309 6.92924 11.6279 5.41996 8.56633 6.74777 4.59269 8.99696 9.82139 numMergedOcc 0
40 mol 197 unq 1 iso 0 dist 7.40027 5.29309 6.92924 11.6279 5.41996 8.56633 13.021 11.3267 7.85058 8.72637 numMergedOcc 0
41 mol 197 unq 2 iso 0 dist 7.40027 5.29309 6.92924 11.6279 5.41996 8.56633 12.0882 6.31157 9.96638 5.69148 numMergedOcc 0
42 mol 197 unq 3 iso 0 dist 8.98598 4.57437 7.50013 12.5442 8.46623 8.56633 9.62514 11.1666 8.99696 9.82139 numMergedOcc 0
43 mol 197 unq 4 iso 0 dist 8.98598 4.57437 7.50013 12.5442 8.46623 8.56633 10.7449 5.53129 7.85058 8.72637 numMergedOcc 0
44 mol 197 unq 5 iso 0 dist 8.98598 4.57437 7.50013 12.5442 8.46623 8.56633 12.2732 6.46195 9.96638 5.69148 numMergedOcc 0
45 mol 197 unq 6 iso 0 dist 7.06689 4.57437 5.81233 12.5442 10.7305 8.56633 9.62514 13.3562 8.99696 9.82139 numMergedOcc 0
46 mol 197 unq 7 iso 0 dist 7.06689 4.57437 5.81233 12.5442 10.7305 8.56633 10.7449 4.38296 7.85058 8.72637 numMergedOcc 0
47 mol 197 unq 8 iso 0 dist 7.06689 4.57437 5.81233 12.5442 10.7305 8.56633 12.2732 11.0356 9.96638 5.69148 numMergedOcc 0
48 mol 197 unq 9 iso 0 dist 9.69601 4.57437 6.92924 12.5442 5.41996 8.56633 9.62514 4.59269 8.99696 9.82139 numMergedOcc 0
49 mol 197 unq 10 iso 0 dist 9.69601 4.57437 6.92924 12.5442 5.41996 8.56633 10.7449 11.3267 7.85058 8.72637 numMergedOcc 0
50 mol 197 unq 11 iso 0 dist 9.69601 4.57437 6.92924 12.5442 5.41996 8.56633 12.2732 6.31157 9.96638 5.69148 numMergedOcc 0
51 mol 204 unq 0 iso 0 dist 8.62191 18.2283 9.68728 14.9107 7.67571 7.10633 18.6825 11.145 5.90931 5.09262 numMergedOcc 0
52 mol 204 unq 1 iso 0 dist 8.62191 18.2283 9.68728 18.4353 10.8573 8.51516 18.6825 11.145 5.90931 12.9483 numMergedOcc 0
53 mol 222 unq 0 iso 0 dist 5.89818 4.82768 7.67576 10.8522 10.3151 8.01589 7.35476 7.39748 6.82208 4.8892 numMergedOcc 0
54 mol 222 unq 1 iso 0 dist 5.89818 4.82768 7.67576 10.0664 7.81022 7.7699 7.35476 7.39748 6.82208 11.0074 numMergedOcc 0
55 mol 222 unq 2 iso 0 dist 5.89818 4.82768 7.67576 7.85877 7.75656 7.21333 7.35476 7.39748 6.82208 12.2813 numMergedOcc 0
56 mol 222 unq 3 iso 0 dist 9.32543 4.82768 9.82371 10.8522 8.52017 8.01589 7.35476 5.08928 6.82208 4.8892 numMergedOcc 0
57 mol 222 unq 4 iso 0 dist 9.32543 4.82768 9.82371 10.0664 15.7504 7.7699 7.35476 5.08928 6.82208 11.0074 numMergedOcc 0
58 mol 222 unq 5 iso 0 dist 9.32543 4.82768 9.82371 7.85877 16.0949 7.21333 7.35476 5.08928 6.82208 12.2813 numMergedOcc 0
59 mol 249 unq 0 iso 0 dist 6.58109 9.9244 5.48118 15.0261 10.7772 7.57994 16.4207 10.639 8.83735 5.23473 numMergedOcc 0
60 mol 249 unq 1 iso 0 dist 6.58109 9.9244 5.48118 10.454 7.04666 6.18582 16.4207 10.639 8.83735 7.38675 numMergedOcc 0
61 mol 264 unq 0 iso 0 dist 9.3201 3.93713 7.16853 13.1873 11.1431 9.361 11.0809 9.76317 9.0012 9.74238 numMergedOcc 0
62 mol 264 unq 1 iso 0 dist 9.3201 3.93713 7.16853 13.1873 11.1431 9.361 11.1852 13.9064 9.5784 9.85579 numMergedOcc 0
63 mol 264 unq 2 iso 0 dist 9.3201 3.93713 7.16853 8.19504 5.00209 6.24356 11.0809 9.76317 9.0012 5.12409 numMergedOcc 0
64 mol 264 unq 3 iso 0 dist 9.3201 3.93713 7.16853 8.19504 5.00209 6.24356 11.1852 13.9064 9.5784 9.67998 numMergedOcc 0
