0 mol 15 unq 0 iso 0 dist 9.70735 9.5538 7.12903 17.6319 11.6322 9.20338 numMergedOcc 0
1 mol 16 unq 0 iso 0 dist 6.84569 5.66529 6.58035 8.46837 6.43294 5.77753 numMergedOcc 0
2 mol 39 unq 0 iso 0 dist 9.45639 6.82829 7.33969 12.495 7.14422 8.28439 numMergedOcc 0
3 mol 39 unq 1 iso 0 dist 5.00126 6.37567 7.33969 10.6989 7.14422 8.28439 numMergedOcc 0
4 mol 45 unq 0 iso 0 dist 9.17045 10.9036 6.99408 13.6578 5.2876 6.94727 numMergedOcc 0
5 mol 45 unq 1 iso 0 dist 6.32012 5.19805 6.99408 5.90391 5.2876 6.94727 numMergedOcc 0
6 mol 73 unq 0 iso 0 dist 6.10011 10.0721 5.64598 7.84699 8.04817 6.4154 numMergedOcc 0
7 mol 73 unq 1 iso 0 dist 8.124 10.0721 4.65521 7.84699 5.2774 6.4154 numMergedOcc 0
8 mol 86 unq 0 iso 0 dist 8.40609 6.82648 7.79359 10.2928 4.98527 9.54683 numMergedOcc 0
9 mol 100 unq 0 iso 0 dist 5.70279 11.8754 7.75343 12.9812 7.58985 9.82043 numMergedOcc 0
10 mol 102 unq 0 iso 0 dist 9.84673 7.6114 9.94856 10.8539 5.54551 9.50209 numMergedOcc 0
11 mol 115 unq 0 iso 0 dist 6.04412 5.97684 6.50039 8.16113 5.71451 5.60716 numMergedOcc 0
12 mol 115 unq 1 iso 0 dist 6.04412 5.97684 6.50039 9.69719 5.889 5.52706 numMergedOcc 0
13 mol 134 unq 0 iso 0 dist 6.54987 6.63186 7.77454 9.21999 10.3334 8.33489 numMergedOcc 0
14 mol 147 unq 0 iso 0 dist 6.87299 5.16833 8.33261 4.95086 5.90364 5.96285 numMergedOcc 0
15 mol 195 unq 0 iso 0 dist 8.3705 12.124 8.36117 19.8913 12.8875 9.30817 numMergedOcc 0
16 mol 222 unq 0 iso 0 dist 8.5834 4.78647 7.18956 7.10689 4.28891 5.04916 numMergedOcc 0
17 mol 224 unq 0 iso 0 dist 9.73411 9.9234 6.87664 15.0577 5.63485 8.60781 numMergedOcc 0
18 mol 224 unq 1 iso 0 dist 7.07564 4.92261 6.87664 7.7163 5.63485 8.60781 numMergedOcc 0
19 mol 227 unq 0 iso 0 dist 9.60159 7.35206 8.17891 12.3036 14.9329 8.34104 numMergedOcc 0
20 mol 265 unq 0 iso 0 dist 5.3051 6.10503 6.34034 5.10595 5.11366 9.01586 numMergedOcc 0
21 mol 278 unq 0 iso 0 dist 8.83775 9.59763 6.35287 16.6033 9.40662 7.76881 numMergedOcc 0
