0 mol 0 unq 0 iso 0 dist 7.65806 7.46173 6.50942 9.19007 9.64573 10.7182 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 7.65806 7.46173 6.50942 9.56794 6.05328 5.19175 numMergedOcc 0
2 mol 8 unq 0 iso 0 dist 8.96553 5.89134 4.41134 7.3915 7.43529 5.90317 numMergedOcc 0
3 mol 19 unq 0 iso 0 dist 7.20519 7.97324 6.63929 6.92532 12.3486 11.8506 numMergedOcc 0
4 mol 19 unq 1 iso 0 dist 4.54938 7.97324 8.33878 6.92532 5.18512 11.8506 numMergedOcc 0
5 mol 19 unq 2 iso 0 dist 6.864 7.97324 11.8689 6.92532 9.47529 11.8506 numMergedOcc 0
6 mol 26 unq 0 iso 0 dist 8.34347 7.47201 9.49511 8.44506 13.2876 5.40995 numMergedOcc 0
7 mol 43 unq 0 iso 0 dist 5.73819 8.92291 5.54797 8.44903 5.48048 10.7769 numMergedOcc 0
8 mol 52 unq 0 iso 0 dist 9.80098 5.75761 6.55615 9.66501 4.88603 5.58144 numMergedOcc 0
9 mol 52 unq 1 iso 0 dist 7.34143 5.75761 9.64358 9.66501 12.277 5.58144 numMergedOcc 0
10 mol 73 unq 0 iso 0 dist 9.38498 9.33919 15.9091 7.04044 15.7304 4.77132 numMergedOcc 0
11 mol 73 unq 1 iso 0 dist 9.96396 9.33919 7.9151 7.04044 8.26458 4.77132 numMergedOcc 0
12 mol 73 unq 2 iso 0 dist 6.19304 9.79143 7.9151 8.73253 8.26458 4.77132 numMergedOcc 0
13 mol 73 unq 3 iso 0 dist 8.70481 6.43377 7.9151 8.85586 14.8866 8.38774 numMergedOcc 0
14 mol 73 unq 4 iso 0 dist 8.70481 6.43377 7.9151 7.11 8.05119 5.90226 numMergedOcc 0
15 mol 73 unq 5 iso 0 dist 9.75218 9.33919 5.44172 7.04044 8.35241 4.77132 numMergedOcc 0
16 mol 85 unq 0 iso 0 dist 7.97049 9.30021 10.4545 7.1589 6.37974 14.4452 numMergedOcc 0
17 mol 85 unq 1 iso 0 dist 6.19965 9.30021 12.3178 7.1589 5.08358 14.4452 numMergedOcc 0
18 mol 119 unq 0 iso 0 dist 8.73993 6.69217 11.3981 8.56342 4.91132 12.831 numMergedOcc 0
19 mol 119 unq 1 iso 0 dist 8.73993 6.69217 11.3981 6.37542 6.08167 5.57116 numMergedOcc 0
20 mol 170 unq 0 iso 0 dist 9.76807 9.48574 10.9822 8.15099 7.72147 13.6753 numMergedOcc 0
21 mol 175 unq 0 iso 0 dist 9.29945 6.95549 5.32538 8.0154 4.24624 5.84597 numMergedOcc 0
22 mol 230 unq 0 iso 0 dist 6.7547 5.31963 4.98428 6.41286 6.20661 7.24631 numMergedOcc 0
23 mol 234 unq 0 iso 0 dist 8.34494 7.72403 10.3378 8.24186 11.7705 9.42254 numMergedOcc 0
24 mol 234 unq 1 iso 0 dist 6.56247 7.72403 8.83842 8.24186 5.63086 9.42254 numMergedOcc 0
25 mol 234 unq 2 iso 0 dist 9.36357 7.72403 5.43327 8.24186 5.6819 9.42254 numMergedOcc 0
26 mol 234 unq 3 iso 0 dist 9.45496 6.35438 8.83842 7.5366 5.63086 9.42254 numMergedOcc 0
27 mol 234 unq 4 iso 0 dist 6.7625 6.35438 5.43327 7.5366 5.6819 9.42254 numMergedOcc 0
28 mol 234 unq 5 iso 0 dist 8.41436 7.27632 10.6728 9.007 8.16888 9.47702 numMergedOcc 0
29 mol 234 unq 6 iso 0 dist 8.92474 7.27632 5.3919 9.007 5.3211 9.47702 numMergedOcc 0
30 mol 248 unq 0 iso 0 dist 7.21521 9.12664 5.41499 9.77666 5.99459 11.3682 numMergedOcc 0
31 mol 258 unq 0 iso 0 dist 6.60405 8.14531 4.88549 9.53063 6.6525 11.3796 numMergedOcc 0
32 mol 258 unq 1 iso 0 dist 6.42289 8.14531 10.8069 9.53063 5.27959 11.3796 numMergedOcc 0
33 mol 274 unq 0 iso 0 dist 7.56915 6.92434 5.87456 9.56685 5.90436 8.18664 numMergedOcc 0
34 mol 274 unq 1 iso 0 dist 7.56915 6.92434 5.87456 8.49922 9.27829 12.3345 numMergedOcc 0
35 mol 274 unq 2 iso 0 dist 7.56915 6.93875 8.83823 9.56685 5.90436 13.1228 numMergedOcc 0
36 mol 274 unq 3 iso 0 dist 7.56915 6.93875 8.83823 8.49922 9.27829 10.5821 numMergedOcc 0
37 mol 274 unq 4 iso 0 dist 7.56915 6.0868 9.51441 9.56685 5.90436 10.9933 numMergedOcc 0
38 mol 274 unq 5 iso 0 dist 7.56915 6.0868 9.51441 8.49922 9.27829 5.66773 numMergedOcc 0
39 mol 274 unq 6 iso 0 dist 7.56915 6.32856 11.5556 9.56685 5.90436 11.0219 numMergedOcc 0
40 mol 274 unq 7 iso 0 dist 7.56915 6.32856 11.5556 8.49922 9.27829 5.67921 numMergedOcc 0
41 mol 274 unq 8 iso 0 dist 8.49997 6.92434 8.58007 9.56685 12.106 8.18664 numMergedOcc 0
42 mol 274 unq 9 iso 0 dist 8.49997 6.92434 8.58007 8.49922 12.9674 12.3345 numMergedOcc 0
43 mol 274 unq 10 iso 0 dist 8.49997 6.93875 5.66046 9.56685 12.106 13.1228 numMergedOcc 0
44 mol 274 unq 11 iso 0 dist 8.49997 6.93875 5.66046 8.49922 12.9674 10.5821 numMergedOcc 0
45 mol 274 unq 12 iso 0 dist 8.49997 6.0868 10.1323 9.56685 12.106 10.9933 numMergedOcc 0
46 mol 274 unq 13 iso 0 dist 8.49997 6.0868 10.1323 8.49922 12.9674 5.66773 numMergedOcc 0
47 mol 274 unq 14 iso 0 dist 8.49997 6.32856 13.5073 9.56685 12.106 11.0219 numMergedOcc 0
48 mol 274 unq 15 iso 0 dist 8.49997 6.32856 13.5073 8.49922 12.9674 5.67921 numMergedOcc 0
