0 mol 0 unq 0 iso 0 dist 7.96742 6.8892 9.53992 5.55156 11.962 5.85361 6.82018 12.962 13.3928 9.5614 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 7.19397 6.8892 11.5675 5.55156 6.83587 5.85361 6.82018 6.19218 13.3928 9.5614 numMergedOcc 0
2 mol 4 unq 0 iso 0 dist 4.88114 6.12485 9.84838 6.66589 7.86036 6.56189 6.21697 10.9924 6.86951 9.80478 numMergedOcc 0
3 mol 4 unq 1 iso 0 dist 4.88114 9.04027 7.03689 6.66589 7.86036 6.22773 6.21697 10.9924 14.3341 9.80478 numMergedOcc 0
4 mol 64 unq 0 iso 0 dist 9.3473 8.86433 12.8692 9.10915 9.82646 14.8927 6.90646 8.14932 15.1231 8.66921 numMergedOcc 0
5 mol 64 unq 1 iso 0 dist 9.3473 8.86433 12.8692 9.10915 9.82646 14.8927 7.89535 11.9527 15.9783 5.54343 numMergedOcc 0
6 mol 64 unq 2 iso 0 dist 6.08228 5.66803 5.88036 5.54343 5.33496 5.9853 7.89535 10.5812 13.034 9.10915 numMergedOcc 0
7 mol 64 unq 3 iso 0 dist 6.08228 5.66803 5.88036 5.54343 5.33496 5.9853 6.36389 6.17846 10.2564 8.66921 numMergedOcc 0
8 mol 87 unq 0 iso 0 dist 9.10245 9.90256 5.83874 5.26938 5.39287 5.30415 5.38943 12.3515 14.3873 9.1329 numMergedOcc 0
9 mol 87 unq 1 iso 0 dist 9.10245 9.90256 5.83874 5.26938 5.39287 5.30415 6.69898 10.4317 7.57471 6.8014 numMergedOcc 0
10 mol 87 unq 2 iso 0 dist 9.10245 9.90256 5.83874 8.91602 11.6194 11.2095 5.38943 12.3515 14.3873 9.03114 numMergedOcc 0
11 mol 87 unq 3 iso 0 dist 9.10245 5.63748 7.43534 5.26938 5.39287 5.507 5.38943 12.3515 5.62336 9.1329 numMergedOcc 0
12 mol 87 unq 4 iso 0 dist 9.10245 5.63748 7.43534 5.26938 5.39287 5.507 6.69898 10.4317 11.1249 6.8014 numMergedOcc 0
13 mol 87 unq 5 iso 0 dist 9.10245 5.63748 7.43534 8.91602 11.6194 7.26523 5.38943 12.3515 5.62336 9.03114 numMergedOcc 0
14 mol 127 unq 0 iso 0 dist 8.98151 5.83719 8.21735 8.62711 6.75619 11.2447 6.87199 12.2655 12.452 7.73139 numMergedOcc 0
15 mol 127 unq 1 iso 0 dist 8.98151 5.83719 8.21735 8.62711 6.75619 11.2447 12.663 13.273 16.1534 6.66607 numMergedOcc 0
16 mol 220 unq 0 iso 0 dist 7.35148 6.39087 11.4142 7.30244 10.48 12.2765 6.99846 13.8218 9.86144 9.58343 numMergedOcc 0
17 mol 230 unq 0 iso 0 dist 6.88683 9.24729 11.0843 8.33847 6.87235 12.2372 5.96129 7.43793 14.8863 9.12305 numMergedOcc 0
18 mol 258 unq 0 iso 0 dist 6.08181 8.10903 10.8957 8.81059 13.8694 5.90131 7.64421 13.3732 11.866 7.9357 numMergedOcc 0
19 mol 258 unq 1 iso 0 dist 6.08181 8.10903 10.8957 9.12006 14.0402 9.68064 16.5108 22.2227 17.7492 9.47519 numMergedOcc 0
20 mol 258 unq 2 iso 0 dist 6.08181 8.10903 10.8957 9.12006 14.0402 9.68064 7.64421 13.3732 11.866 5.79537 numMergedOcc 0
21 mol 258 unq 3 iso 0 dist 6.08181 7.25618 11.0025 8.81059 13.8694 4.51422 7.64421 13.3732 8.70193 7.9357 numMergedOcc 0
22 mol 258 unq 4 iso 0 dist 6.08181 7.25618 11.0025 9.12006 14.0402 4.99997 16.5108 22.2227 14.1931 9.47519 numMergedOcc 0
23 mol 258 unq 5 iso 0 dist 6.08181 7.25618 11.0025 9.12006 14.0402 4.99997 7.64421 13.3732 8.70193 5.79537 numMergedOcc 0
24 mol 258 unq 6 iso 0 dist 7.70189 8.10903 5.27718 8.81059 9.22664 5.90131 7.64421 12.9422 11.866 7.9357 numMergedOcc 0
25 mol 258 unq 7 iso 0 dist 7.70189 8.10903 5.27718 9.12006 13.0489 9.68064 16.5108 20.0893 17.7492 9.47519 numMergedOcc 0
26 mol 258 unq 8 iso 0 dist 7.70189 8.10903 5.27718 9.12006 13.0489 9.68064 7.64421 12.9422 11.866 5.79537 numMergedOcc 0
27 mol 258 unq 9 iso 0 dist 7.70189 7.25618 9.46467 8.81059 9.22664 4.51422 7.64421 12.9422 8.70193 7.9357 numMergedOcc 0
28 mol 258 unq 10 iso 0 dist 7.70189 7.25618 9.46467 9.12006 13.0489 4.99997 16.5108 20.0893 14.1931 9.47519 numMergedOcc 0
29 mol 258 unq 11 iso 0 dist 7.70189 7.25618 9.46467 9.12006 13.0489 4.99997 7.64421 12.9422 8.70193 5.79537 numMergedOcc 0
30 mol 261 unq 0 iso 0 dist 9.70222 4.85199 10.6318 7.6414 11.544 4.25662 4.70691 14.3042 6.0437 8.50313 numMergedOcc 0
31 mol 261 unq 1 iso 0 dist 9.70222 9.72159 4.97878 7.6414 11.544 12.864 4.70691 14.3042 13.9529 8.50313 numMergedOcc 0
32 mol 279 unq 0 iso 0 dist 5.78017 8.03486 7.78018 6.47376 5.34376 4.51031 6.22487 6.12742 12.7328 9.6147 numMergedOcc 0
33 mol 279 unq 1 iso 0 dist 8.78203 8.03486 5.38411 6.47376 5.86731 4.51031 6.22487 13.8375 12.7328 9.6147 numMergedOcc 0
34 mol 281 unq 0 iso 0 dist 6.7897 6.58925 4.37855 9.48968 5.71767 9.49279 7.20467 10.2015 10.1906 9.64422 numMergedOcc 0
