0 mol 7 unq 0 iso 0 dist 9.34656 16.3136 8.81608 12.8676 10.515 9.67164 6.3236 9.36807 13.156 7.10621 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 9.34656 16.3136 8.81608 13.0935 6.06176 5.99459 15.0884 6.36911 6.88805 8.41585 numMergedOcc 0
2 mol 18 unq 0 iso 0 dist 8.25905 6.82841 5.04478 7.37356 7.04695 5.65084 7.426 12.3965 12.6536 9.51761 numMergedOcc 0
3 mol 18 unq 1 iso 0 dist 8.25905 6.82841 5.04478 7.37356 7.04695 5.65084 7.53082 12.8594 9.36767 7.3094 numMergedOcc 0
4 mol 72 unq 0 iso 0 dist 7.95972 10.6185 6.7272 5.48831 7.17489 9.55118 13.0773 10.4676 5.69391 9.96708 numMergedOcc 0
5 mol 72 unq 1 iso 0 dist 7.95972 10.6185 6.7272 5.48831 7.17489 9.55118 10.5933 13.3943 9.78221 9.78528 numMergedOcc 0
6 mol 72 unq 2 iso 0 dist 7.95972 4.89334 7.64009 5.48831 7.17489 9.10345 13.0773 10.4676 13.4212 9.96708 numMergedOcc 0
7 mol 72 unq 3 iso 0 dist 7.95972 4.89334 7.64009 5.48831 7.17489 9.10345 10.5933 13.3943 11.6634 9.78528 numMergedOcc 0
8 mol 115 unq 0 iso 0 dist 5.43229 9.02908 8.0168 13.352 10.7942 6.39384 5.98221 7.76729 6.63111 9.33865 numMergedOcc 0
9 mol 115 unq 1 iso 0 dist 5.43229 9.02908 8.0168 13.352 10.7942 6.39384 13.0823 12.9821 6.07067 6.11741 numMergedOcc 0
10 mol 115 unq 2 iso 0 dist 5.43229 9.02908 8.0168 11.172 10.9739 9.42082 16.2427 17.6696 15.3161 7.30858 numMergedOcc 0
11 mol 115 unq 3 iso 0 dist 5.43229 9.02908 8.0168 11.172 10.9739 9.42082 5.98221 7.76729 6.63111 5.83991 numMergedOcc 0
12 mol 115 unq 4 iso 0 dist 5.43229 9.02908 8.0168 11.172 10.9739 9.42082 13.0823 12.9821 6.07067 7.88312 numMergedOcc 0
13 mol 133 unq 0 iso 0 dist 4.95674 7.44092 8.55349 9.00172 9.53782 8.77023 13.2145 11.3058 13.0405 6.29155 numMergedOcc 0
14 mol 133 unq 1 iso 0 dist 4.95674 7.44092 8.55349 9.00172 9.53782 8.77023 15.719 16.0613 13.7612 6.80239 numMergedOcc 0
15 mol 133 unq 2 iso 0 dist 4.95674 7.44092 8.55349 9.00172 9.53782 8.77023 14.0905 16.3407 15.0115 8.00618 numMergedOcc 0
16 mol 133 unq 3 iso 0 dist 7.17226 11.0449 8.55349 15.6173 9.53782 8.77023 16.5417 11.3058 13.0405 6.29155 numMergedOcc 0
17 mol 133 unq 4 iso 0 dist 7.17226 11.0449 8.55349 15.6173 9.53782 8.77023 21.5343 16.0613 13.7612 6.80239 numMergedOcc 0
18 mol 133 unq 5 iso 0 dist 7.17226 11.0449 8.55349 15.6173 9.53782 8.77023 22.9908 16.3407 15.0115 8.00618 numMergedOcc 0
19 mol 134 unq 0 iso 0 dist 5.98435 4.72407 6.44575 5.79157 6.74887 9.1998 13.0109 11.2292 12.8086 9.86662 numMergedOcc 0
20 mol 134 unq 1 iso 0 dist 5.98435 4.72407 6.44575 5.79157 6.74887 9.1998 14.1608 10.9613 15.0225 9.71307 numMergedOcc 0
21 mol 134 unq 2 iso 0 dist 5.98435 7.97297 7.43401 9.87619 5.3585 9.33094 13.0109 11.2292 7.41373 8.94367 numMergedOcc 0
22 mol 134 unq 3 iso 0 dist 5.98435 7.97297 7.43401 9.87619 5.3585 9.33094 14.1608 10.9613 10.8635 6.37586 numMergedOcc 0
23 mol 134 unq 4 iso 0 dist 5.98435 7.97297 7.43401 9.87619 5.3585 9.33094 15.8368 10.9685 12.3479 6.49416 numMergedOcc 0
24 mol 134 unq 5 iso 0 dist 5.98435 7.97297 7.43401 5.79157 6.74887 8.69531 13.0109 11.2292 7.41373 9.86662 numMergedOcc 0
25 mol 134 unq 6 iso 0 dist 5.98435 7.97297 7.43401 5.79157 6.74887 8.69531 14.1608 10.9613 10.8635 9.71307 numMergedOcc 0
26 mol 143 unq 0 iso 0 dist 7.13287 9.1255 7.05845 12.4841 6.01455 7.36975 16.0238 9.27292 13.1926 5.99315 numMergedOcc 0
27 mol 155 unq 0 iso 0 dist 9.70106 4.33327 7.29911 12.6012 12.8482 8.97626 10.3633 15.9495 9.16779 7.46303 numMergedOcc 0
28 mol 155 unq 1 iso 0 dist 9.70106 4.33327 7.29911 12.6012 12.8482 8.97626 7.52846 9.38946 4.91785 6.43582 numMergedOcc 0
29 mol 234 unq 0 iso 0 dist 7.54327 16.363 9.11572 11.234 5.56749 7.81215 19.7526 15.004 12.4252 9.45496 numMergedOcc 0
30 mol 234 unq 1 iso 0 dist 7.54327 16.363 9.11572 11.234 5.56749 7.81215 17.7382 10.8628 5.75498 6.7625 numMergedOcc 0
31 mol 272 unq 0 iso 0 dist 6.27189 13.4399 8.84523 12.454 6.64985 6.44147 9.92738 7.67853 5.12237 8.48753 numMergedOcc 0
