0 mol 8 unq 0 iso 0 dist 4.92734 6.26138 6.31827 7.35767 8.96553 12.1933 7.0822 8.33604 12.8095 8.27181 numMergedOcc 0
1 mol 8 unq 1 iso 0 dist 4.92734 6.57999 8.4069 7.35767 8.96553 9.62879 7.0822 8.33604 13.3876 8.27181 numMergedOcc 0
2 mol 72 unq 0 iso 0 dist 6.68311 9.96602 10.1538 8.1124 8.8178 13.4854 13.1473 6.77912 15.4914 12.0644 numMergedOcc 0
3 mol 72 unq 1 iso 0 dist 6.68311 9.96602 10.1538 15.0607 9.96708 15.1902 13.1473 6.77912 15.4914 7.11552 numMergedOcc 0
4 mol 72 unq 2 iso 0 dist 6.7212 9.08821 5.82403 11.6369 9.96708 13.9308 5.00053 7.321 12.0769 9.0131 numMergedOcc 0
5 mol 72 unq 3 iso 0 dist 6.7212 9.08821 5.82403 6.12361 9.78528 12.4486 5.00053 7.321 12.0769 6.11922 numMergedOcc 0
6 mol 73 unq 0 iso 0 dist 6.10011 8.124 5.7113 8.3449 5.93252 11.379 10.0721 5.64598 4.65521 9.77992 numMergedOcc 0
7 mol 73 unq 1 iso 0 dist 8.124 6.10011 5.7113 13.4367 6.19304 11.4799 10.0721 4.65521 5.64598 7.41074 numMergedOcc 0
8 mol 100 unq 0 iso 0 dist 5.70279 8.96916 5.33144 5.92158 7.47343 6.45675 11.8754 7.75343 11.8016 15.209 numMergedOcc 0
9 mol 100 unq 1 iso 0 dist 5.70279 8.96916 5.33144 5.85449 6.65086 10.1409 11.8754 7.75343 11.8016 10.9608 numMergedOcc 0
10 mol 100 unq 2 iso 0 dist 5.70279 8.96916 5.33144 7.68675 6.56369 11.8665 11.8754 7.75343 11.8016 5.69137 numMergedOcc 0
11 mol 100 unq 3 iso 0 dist 5.70279 8.96916 5.33144 9.53223 9.30209 13.912 11.8754 7.75343 11.8016 9.21622 numMergedOcc 0
12 mol 109 unq 0 iso 0 dist 8.84523 9.45397 4.98336 14.7654 8.69985 13.4572 5.38332 5.87358 9.20981 9.46098 numMergedOcc 0
13 mol 134 unq 0 iso 0 dist 7.27598 5.57904 5.00817 6.50005 6.37586 6.49416 7.26771 5.42582 8.6355 5.41704 numMergedOcc 0
14 mol 134 unq 1 iso 0 dist 7.27598 5.57904 5.00817 12.0971 9.71307 12.5075 7.26771 5.42582 8.6355 6.17103 numMergedOcc 0
15 mol 134 unq 2 iso 0 dist 5.57904 7.27598 5.00817 7.41837 6.54501 9.5126 7.26771 8.6355 5.42582 10.1448 numMergedOcc 0
16 mol 134 unq 3 iso 0 dist 5.57904 7.27598 5.00817 6.50005 6.49416 6.37586 7.26771 8.6355 5.42582 5.41704 numMergedOcc 0
17 mol 156 unq 0 iso 0 dist 9.19499 7.11647 5.56175 5.66289 7.44554 8.94056 11.9162 9.36805 13.1853 6.29785 numMergedOcc 0
18 mol 222 unq 0 iso 0 dist 8.5834 8.7419 6.8425 5.01062 7.54212 6.00706 4.78647 7.18956 10.8957 7.61682 numMergedOcc 0
19 mol 224 unq 0 iso 0 dist 9.73411 7.75485 5.60236 14.1073 8.95269 14.0676 9.9234 6.87664 10.2775 7.98696 numMergedOcc 0
20 mol 224 unq 1 iso 0 dist 9.73411 7.75485 5.60236 9.81806 6.57273 10.5128 9.9234 6.87664 10.2775 7.12232 numMergedOcc 0
21 mol 224 unq 2 iso 0 dist 9.73411 7.75485 5.60236 5.99647 5.78342 5.81334 9.9234 6.87664 10.2775 5.3621 numMergedOcc 0
22 mol 224 unq 3 iso 0 dist 7.07564 9.11052 5.60236 11.8217 8.95269 14.0676 4.92261 6.87664 10.2775 7.98696 numMergedOcc 0
23 mol 224 unq 4 iso 0 dist 7.07564 9.11052 5.60236 10.8463 6.57273 10.5128 4.92261 6.87664 10.2775 7.12232 numMergedOcc 0
24 mol 224 unq 5 iso 0 dist 7.07564 9.11052 5.60236 5.44863 5.78342 5.81334 4.92261 6.87664 10.2775 5.3621 numMergedOcc 0
25 mol 238 unq 0 iso 0 dist 4.87108 7.64276 5.34096 7.45873 6.22714 7.31233 5.61491 7.49471 7.19008 5.17471 numMergedOcc 0
26 mol 238 unq 1 iso 0 dist 7.64276 4.87108 5.34096 7.45873 7.31233 6.22714 13.9044 6.55759 10.5202 10.4664 numMergedOcc 0
27 mol 238 unq 2 iso 0 dist 7.64276 4.87108 5.34096 7.45873 7.31233 6.22714 13.3748 7.02475 12.1784 11.2717 numMergedOcc 0
28 mol 238 unq 3 iso 0 dist 7.64276 4.87108 5.34096 7.45873 7.31233 6.22714 11.6924 7.67322 12.1937 12.6986 numMergedOcc 0
29 mol 238 unq 4 iso 0 dist 7.64276 4.87108 5.34096 7.45873 7.31233 6.22714 5.61491 7.19008 7.49471 5.17471 numMergedOcc 0
30 mol 278 unq 0 iso 0 dist 8.83775 7.58272 8.29447 4.66992 8.44326 10.6095 9.59763 6.35287 12.1774 6.07447 numMergedOcc 0
