0 mol 13 unq 0 iso 0 dist 7.71544 9.44958 10.8881 11.4587 9.37413 8.00865 numMergedOcc 0
1 mol 13 unq 1 iso 0 dist 7.71544 9.44958 10.8881 4.14738 9.18487 9.11447 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 8.6112 6.73259 6.29311 10.1809 13.7373 7.61055 numMergedOcc 0
3 mol 41 unq 0 iso 0 dist 9.59131 8.19484 4.15148 5.14132 8.91418 5.52067 numMergedOcc 0
4 mol 76 unq 0 iso 0 dist 9.4022 7.81334 4.28388 5.72925 11.726 8.69209 numMergedOcc 0
5 mol 120 unq 0 iso 0 dist 8.43293 9.27951 4.63594 9.70923 11.1011 8.43028 numMergedOcc 0
6 mol 130 unq 0 iso 0 dist 8.80041 7.62584 7.19014 4.9574 9.82201 6.42785 numMergedOcc 0
7 mol 133 unq 0 iso 0 dist 7.12336 7.34386 11.3259 5.80615 11.5756 9.4062 numMergedOcc 0
8 mol 154 unq 0 iso 0 dist 7.10223 9.2042 7.86748 12.9483 13.5353 7.53158 numMergedOcc 0
9 mol 154 unq 1 iso 0 dist 7.10223 9.2042 7.86748 9.90775 12.9564 7.43407 numMergedOcc 0
10 mol 163 unq 0 iso 0 dist 7.7264 9.3832 15.0568 14.7696 21.9462 8.21476 numMergedOcc 0
11 mol 163 unq 1 iso 0 dist 7.7264 9.3832 15.0568 9.55472 16.8164 7.66897 numMergedOcc 0
12 mol 163 unq 2 iso 0 dist 7.5447 6.0247 3.64474 6.00005 8.70104 8.21476 numMergedOcc 0
13 mol 163 unq 3 iso 0 dist 7.5447 6.0247 3.64474 6.69711 10.6592 7.66897 numMergedOcc 0
14 mol 237 unq 0 iso 0 dist 9.18638 9.74081 6.08522 9.68452 11.5415 7.35569 numMergedOcc 0
15 mol 243 unq 0 iso 0 dist 5.86679 5.66593 4.2759 4.12468 8.53888 6.01071 numMergedOcc 0
16 mol 243 unq 1 iso 0 dist 8.28347 5.66593 5.81296 4.12468 9.46855 6.01071 numMergedOcc 0
17 mol 286 unq 0 iso 0 dist 5.03123 7.3415 6.77784 8.56408 12.2509 8.72146 numMergedOcc 0
