0 mol 55 unq 0 iso 0 dist 8.61209 4.31691 6.66861 10.4009 4.19247 9.3341 numMergedOcc 0
1 mol 55 unq 1 iso 0 dist 5.7638 6.96815 6.66861 5.12277 4.19247 9.3341 numMergedOcc 0
2 mol 55 unq 2 iso 0 dist 8.55679 6.96815 6.72084 5.12277 6.83997 9.3341 numMergedOcc 0
3 mol 83 unq 0 iso 0 dist 9.04648 9.64796 5.91009 16.7526 11.3005 9.52901 numMergedOcc 0
4 mol 91 unq 0 iso 0 dist 7.62621 5.75219 5.51406 8.42914 4.23238 7.42828 numMergedOcc 0
5 mol 91 unq 1 iso 0 dist 7.62621 5.75219 5.51406 8.17327 6.31416 5.98441 numMergedOcc 0
6 mol 91 unq 2 iso 0 dist 7.62621 5.75219 5.51406 9.52936 4.23182 5.45873 numMergedOcc 0
7 mol 93 unq 0 iso 0 dist 8.52947 14.4934 7.4518 19.1038 10.7482 6.58492 numMergedOcc 0
8 mol 93 unq 1 iso 0 dist 8.52947 14.4934 7.4518 22.1224 14.6717 7.63783 numMergedOcc 0
9 mol 93 unq 2 iso 0 dist 8.84466 16.0131 7.4518 17.1744 10.7482 6.58492 numMergedOcc 0
10 mol 93 unq 3 iso 0 dist 8.84466 16.0131 7.4518 22.4868 14.6717 7.63783 numMergedOcc 0
11 mol 100 unq 0 iso 0 dist 9.79412 9.68856 9.16592 12.6439 5.97184 6.34031 numMergedOcc 0
12 mol 147 unq 0 iso 0 dist 6.28769 8.52762 9.41073 11.9932 10.7499 6.6094 numMergedOcc 0
13 mol 147 unq 1 iso 0 dist 6.28769 8.52762 9.41073 17.8255 16.1629 9.70579 numMergedOcc 0
14 mol 147 unq 2 iso 0 dist 6.28769 8.52762 9.41073 13.1466 9.53448 8.514 numMergedOcc 0
15 mol 173 unq 0 iso 0 dist 9.99743 12.1363 9.51638 9.88796 3.95563 6.07708 numMergedOcc 0
16 mol 247 unq 0 iso 0 dist 8.72346 5.81946 6.18065 10.7683 7.28781 5.18532 numMergedOcc 0
17 mol 247 unq 1 iso 0 dist 7.39069 11.7687 6.18065 12.8943 7.28781 5.18532 numMergedOcc 0
18 mol 253 unq 0 iso 0 dist 7.02076 12.8127 9.34735 17.4843 10.7375 9.75905 numMergedOcc 0
19 mol 253 unq 1 iso 0 dist 7.02076 12.8127 9.34735 11.1441 6.34554 9.46975 numMergedOcc 0
20 mol 253 unq 2 iso 0 dist 7.02076 12.8127 9.34735 22.2455 17.1127 9.9268 numMergedOcc 0
21 mol 268 unq 0 iso 0 dist 9.7384 8.90545 8.6745 14.5052 10.3475 9.71278 numMergedOcc 0
22 mol 278 unq 0 iso 0 dist 8.78758 4.19643 9.21145 6.08019 7.42864 9.62872 numMergedOcc 0
