0 mol 13 unq 0 iso 0 dist 9.1093 6.24522 5.86973 10.2967 7.71544 11.6449 numMergedOcc 0
1 mol 41 unq 0 iso 0 dist 8.6783 6.74265 10.8697 12.5664 9.59131 17.813 numMergedOcc 0
2 mol 53 unq 0 iso 0 dist 7.08383 9.26043 6.98616 4.44768 8.27455 6.64564 numMergedOcc 0
3 mol 53 unq 1 iso 0 dist 7.08383 7.72123 10.4874 4.44768 8.27455 11.8553 numMergedOcc 0
4 mol 79 unq 0 iso 0 dist 9.04935 7.78105 7.95422 5.87135 7.74131 11.3357 numMergedOcc 0
5 mol 109 unq 0 iso 0 dist 4.87856 7.39303 10.6021 4.91384 7.59374 11.5256 numMergedOcc 0
6 mol 123 unq 0 iso 0 dist 7.25497 7.99359 5.8424 4.99882 8.71274 8.56386 numMergedOcc 0
7 mol 123 unq 1 iso 0 dist 7.25497 9.14514 10.835 4.99882 8.71274 7.15869 numMergedOcc 0
8 mol 133 unq 0 iso 0 dist 5.7232 8.13344 6.49614 6.45157 7.12336 4.69402 numMergedOcc 0
9 mol 165 unq 0 iso 0 dist 7.6166 9.42821 9.15311 6.17559 7.65047 14.0153 numMergedOcc 0
10 mol 233 unq 0 iso 0 dist 6.01193 6.50096 4.69192 3.63541 9.06304 8.20598 numMergedOcc 0
11 mol 233 unq 1 iso 0 dist 7.40749 9.91416 4.69192 6.30963 9.06304 8.20598 numMergedOcc 0
12 mol 233 unq 2 iso 0 dist 9.49046 8.27169 12.4724 13.0673 7.74693 18.76 numMergedOcc 0
13 mol 258 unq 0 iso 0 dist 8.6856 9.44669 6.30651 9.48658 9.64278 14.0918 numMergedOcc 0
14 mol 258 unq 1 iso 0 dist 9.98868 9.44669 10.8524 9.48658 6.15713 14.0918 numMergedOcc 0
15 mol 283 unq 0 iso 0 dist 8.28068 9.16563 6.27944 5.70683 8.36393 12.1426 numMergedOcc 0
16 mol 287 unq 0 iso 0 dist 7.90634 9.04355 5.66584 12.8871 9.39409 6.76192 numMergedOcc 0
17 mol 287 unq 1 iso 0 dist 7.90634 8.50508 5.27724 12.8871 9.39409 14.3463 numMergedOcc 0
18 mol 288 unq 0 iso 0 dist 7.90634 9.04355 5.66584 12.8871 9.39409 6.76192 numMergedOcc 0
19 mol 288 unq 1 iso 0 dist 7.90634 8.50508 5.27724 12.8871 9.39409 14.3463 numMergedOcc 0
20 mol 289 unq 0 iso 0 dist 7.90634 9.04355 5.66584 12.8871 9.39409 6.76192 numMergedOcc 0
21 mol 289 unq 1 iso 0 dist 7.90634 8.50508 5.27724 12.8871 9.39409 14.3463 numMergedOcc 0
