0 mol 0 unq 0 iso 0 dist 9.99338 14.2251 6.15923 12.7627 5.92155 6.3267 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 8.13129 5.08793 6.15923 10.9812 5.92155 6.3267 numMergedOcc 0
2 mol 0 unq 2 iso 0 dist 9.07223 10.4498 6.15923 14.3013 5.92155 6.3267 numMergedOcc 0
3 mol 8 unq 0 iso 0 dist 5.89134 4.85329 5.99042 8.33604 5.93269 6.26865 numMergedOcc 0
4 mol 15 unq 0 iso 0 dist 7.876 5.90976 9.90484 10.2713 5.3298 8.96967 numMergedOcc 0
5 mol 15 unq 1 iso 0 dist 8.63502 5.51916 9.90484 9.78051 5.3298 8.96967 numMergedOcc 0
6 mol 42 unq 0 iso 0 dist 8.08117 11.1435 7.84482 15.5195 11.5281 6.98046 numMergedOcc 0
7 mol 42 unq 1 iso 0 dist 8.4184 9.34878 8.01046 12.4939 5.39648 6.98046 numMergedOcc 0
8 mol 42 unq 2 iso 0 dist 8.4184 5.08257 8.2717 10.4608 6.067 8.52615 numMergedOcc 0
9 mol 88 unq 0 iso 0 dist 6.066 5.90098 9.64465 8.66514 7.39092 7.71582 numMergedOcc 0
10 mol 88 unq 1 iso 0 dist 6.066 5.90098 9.64465 9.25235 8.30564 6.65776 numMergedOcc 0
11 mol 88 unq 2 iso 0 dist 9.36032 4.58465 9.64465 10.6733 7.39092 7.71582 numMergedOcc 0
12 mol 88 unq 3 iso 0 dist 9.36032 4.58465 9.64465 8.69012 8.30564 6.65776 numMergedOcc 0
13 mol 88 unq 4 iso 0 dist 8.3592 14.227 9.64465 15.3017 7.39092 7.71582 numMergedOcc 0
14 mol 88 unq 5 iso 0 dist 8.3592 14.227 9.64465 14.4879 8.30564 6.65776 numMergedOcc 0
15 mol 127 unq 0 iso 0 dist 5.72373 4.77464 6.11979 8.59981 4.98036 6.3244 numMergedOcc 0
16 mol 127 unq 1 iso 0 dist 7.20988 7.11695 6.11979 7.66331 4.98036 6.3244 numMergedOcc 0
17 mol 133 unq 0 iso 0 dist 6.05583 10.6871 8.21182 11.444 6.14787 9.94276 numMergedOcc 0
18 mol 133 unq 1 iso 0 dist 6.05583 7.58137 7.5547 11.444 6.14787 9.05357 numMergedOcc 0
19 mol 133 unq 2 iso 0 dist 6.05583 13.9603 9.31771 11.444 6.14787 5.99299 numMergedOcc 0
20 mol 194 unq 0 iso 0 dist 7.61316 7.82648 5.11333 7.58278 5.14638 6.41318 numMergedOcc 0
21 mol 213 unq 0 iso 0 dist 8.29133 12.2579 5.18463 9.59129 8.3461 8.74171 numMergedOcc 0
22 mol 213 unq 1 iso 0 dist 8.29133 12.2579 5.18463 12.5357 6.34629 6.85195 numMergedOcc 0
23 mol 213 unq 2 iso 0 dist 8.29133 15.28 7.06118 12.5357 6.34629 6.17451 numMergedOcc 0
24 mol 213 unq 3 iso 0 dist 8.96646 13.2686 5.18463 13.8919 8.3461 8.74171 numMergedOcc 0
25 mol 213 unq 4 iso 0 dist 8.96646 13.2686 5.18463 14.6782 6.34629 6.85195 numMergedOcc 0
26 mol 213 unq 5 iso 0 dist 8.96646 15.6315 7.06118 14.6782 6.34629 6.17451 numMergedOcc 0
27 mol 225 unq 0 iso 0 dist 8.25629 7.97944 5.74825 13.4461 7.96309 9.36396 numMergedOcc 0
28 mol 225 unq 1 iso 0 dist 9.31373 7.12954 5.74825 5.50387 7.96309 9.36396 numMergedOcc 0
29 mol 225 unq 2 iso 0 dist 9.20561 11.8629 5.74825 12.9623 7.96309 9.36396 numMergedOcc 0
30 mol 225 unq 3 iso 0 dist 9.88976 14.2819 5.74825 9.88956 7.96309 9.36396 numMergedOcc 0
31 mol 234 unq 0 iso 0 dist 7.72403 10.6156 9.76304 10.3388 10.0213 8.49841 numMergedOcc 0
32 mol 234 unq 1 iso 0 dist 7.72403 15.0456 8.83027 10.3388 10.0213 9.6101 numMergedOcc 0
33 mol 234 unq 2 iso 0 dist 7.72403 15.0456 8.83027 11.6207 5.16504 5.32183 numMergedOcc 0
34 mol 234 unq 3 iso 0 dist 6.35438 5.56749 9.76304 9.5707 10.0213 8.49841 numMergedOcc 0
35 mol 234 unq 4 iso 0 dist 6.35438 12.1076 8.83027 9.5707 10.0213 9.6101 numMergedOcc 0
36 mol 234 unq 5 iso 0 dist 6.35438 12.1076 8.83027 10.475 5.16504 5.32183 numMergedOcc 0
37 mol 234 unq 6 iso 0 dist 9.07916 6.29366 6.92793 11.8897 13.7546 9.6101 numMergedOcc 0
38 mol 234 unq 7 iso 0 dist 9.07916 6.29366 6.92793 9.39181 4.86801 5.32183 numMergedOcc 0
39 mol 234 unq 8 iso 0 dist 9.57132 8.0608 9.76304 11.8897 10.0213 8.49841 numMergedOcc 0
40 mol 234 unq 9 iso 0 dist 9.57132 6.29366 8.83027 11.8897 10.0213 9.6101 numMergedOcc 0
41 mol 234 unq 10 iso 0 dist 9.57132 6.29366 8.83027 9.39181 5.16504 5.32183 numMergedOcc 0
42 mol 234 unq 11 iso 0 dist 7.27632 5.9221 6.55256 6.16063 10.6582 8.49841 numMergedOcc 0
43 mol 234 unq 12 iso 0 dist 7.27632 5.9221 6.55256 11.4691 6.91711 9.6101 numMergedOcc 0
44 mol 239 unq 0 iso 0 dist 9.1242 15.8644 9.95624 19.6211 11.3738 6.34801 numMergedOcc 0
45 mol 239 unq 1 iso 0 dist 7.61762 9.9012 9.95624 14.781 11.3738 6.34801 numMergedOcc 0
46 mol 270 unq 0 iso 0 dist 8.34847 5.92046 8.99244 12.3544 9.09053 9.16073 numMergedOcc 0
47 mol 270 unq 1 iso 0 dist 8.34847 5.92046 8.99244 10.3858 4.23786 8.39167 numMergedOcc 0
48 mol 270 unq 2 iso 0 dist 8.34847 6.88143 7.8423 12.3544 9.09053 6.79822 numMergedOcc 0
49 mol 270 unq 3 iso 0 dist 8.34847 6.88143 7.8423 10.3858 4.23786 9.17227 numMergedOcc 0
50 mol 270 unq 4 iso 0 dist 9.73905 15.1125 8.99244 18.4526 9.09053 9.16073 numMergedOcc 0
51 mol 270 unq 5 iso 0 dist 9.73905 15.1125 8.99244 13.3096 4.23786 8.39167 numMergedOcc 0
52 mol 270 unq 6 iso 0 dist 9.73905 14.4924 7.8423 18.4526 9.09053 6.79822 numMergedOcc 0
53 mol 270 unq 7 iso 0 dist 9.73905 14.4924 7.8423 13.3096 4.23786 9.17227 numMergedOcc 0
