0 mol 16 unq 0 iso 0 dist 8.7585 6.86324 7.48255 5.95758 11.482 8.84153 numMergedOcc 0
1 mol 16 unq 1 iso 0 dist 5.59641 6.32791 5.59769 11.2652 14.0448 9.04834 numMergedOcc 0
2 mol 17 unq 0 iso 0 dist 9.52568 9.55169 11.7814 5.57445 9.26685 6.53817 numMergedOcc 0
3 mol 17 unq 1 iso 0 dist 9.15735 9.55169 14.955 5.57445 14.0984 6.53817 numMergedOcc 0
4 mol 22 unq 0 iso 0 dist 9.00263 8.05363 4.7626 6.00963 10.0195 8.0931 numMergedOcc 0
5 mol 22 unq 1 iso 0 dist 9.00263 8.05363 4.7626 7.13897 12.5122 9.109 numMergedOcc 0
6 mol 38 unq 0 iso 0 dist 6.70575 4.82342 5.39129 4.28643 5.86243 7.57586 numMergedOcc 0
7 mol 51 unq 0 iso 0 dist 4.97772 5.67627 5.27155 5.44083 7.95419 9.06397 numMergedOcc 0
8 mol 56 unq 0 iso 0 dist 7.6585 7.59663 5.47911 8.77769 10.1808 8.04926 numMergedOcc 0
9 mol 56 unq 1 iso 0 dist 9.71282 7.59663 7.40093 8.77769 11.2096 8.04926 numMergedOcc 0
10 mol 68 unq 0 iso 0 dist 8.56621 9.74289 7.1369 12.791 11.1544 6.87176 numMergedOcc 0
11 mol 68 unq 1 iso 0 dist 8.56621 9.74289 7.1369 10.2048 11.7811 5.57389 numMergedOcc 0
12 mol 170 unq 0 iso 0 dist 7.70662 7.665 8.83341 6.63708 12.1211 7.15418 numMergedOcc 0
13 mol 232 unq 0 iso 0 dist 7.38809 6.94983 13.6402 12.1757 18.7039 7.47238 numMergedOcc 0
14 mol 236 unq 0 iso 0 dist 5.50501 6.0087 10.054 15.6486 20.0044 9.97357 numMergedOcc 0
15 mol 258 unq 0 iso 0 dist 9.41308 8.14812 5.09738 11.49 6.08181 9.67877 numMergedOcc 0
16 mol 264 unq 0 iso 0 dist 5.11475 6.66602 5.11257 5.17977 7.61232 6.80096 numMergedOcc 0
17 mol 279 unq 0 iso 0 dist 8.2905 9.60619 9.40038 10.5154 13.639 5.17586 numMergedOcc 0
18 mol 279 unq 1 iso 0 dist 9.47256 9.60619 14.0595 10.5154 17.6435 5.17586 numMergedOcc 0
19 mol 281 unq 0 iso 0 dist 9.29634 8.32692 6.06716 9.88161 14.2674 9.48968 numMergedOcc 0
20 mol 281 unq 1 iso 0 dist 9.29634 8.32692 6.06716 9.38131 14.7597 9.64422 numMergedOcc 0
