0 mol 34 unq 0 iso 0 dist 9.25424 6.45654 8.0991 6.93364 4.06864 6.15801 numMergedOcc 0
1 mol 34 unq 1 iso 0 dist 9.25424 11.9626 8.80175 6.93364 4.06864 9.63403 numMergedOcc 0
2 mol 34 unq 2 iso 0 dist 7.69101 6.45654 9.95093 6.93364 5.9339 6.15801 numMergedOcc 0
3 mol 34 unq 3 iso 0 dist 9.57665 7.35043 9.95093 6.34821 5.9339 6.15801 numMergedOcc 0
4 mol 48 unq 0 iso 0 dist 7.16443 12.9941 7.11491 19.0066 12.5266 7.59316 numMergedOcc 0
5 mol 48 unq 1 iso 0 dist 7.08628 13.0328 7.1829 19.1836 12.6408 7.51285 numMergedOcc 0
6 mol 48 unq 2 iso 0 dist 7.08628 13.0328 7.1829 14.829 9.01238 8.86698 numMergedOcc 0
7 mol 56 unq 0 iso 0 dist 5.42296 6.56778 9.09425 5.86571 3.91174 6.99108 numMergedOcc 0
8 mol 58 unq 0 iso 0 dist 8.98478 8.88332 6.41008 12.8203 6.21346 6.62229 numMergedOcc 0
9 mol 79 unq 0 iso 0 dist 7.90338 9.00783 8.96069 16.2903 11.6533 9.36156 numMergedOcc 0
10 mol 90 unq 0 iso 0 dist 6.18681 4.48233 8.61893 7.54496 4.67883 7.31784 numMergedOcc 0
11 mol 129 unq 0 iso 0 dist 8.86956 6.6028 8.98175 13.9488 7.42801 9.98397 numMergedOcc 0
12 mol 129 unq 1 iso 0 dist 8.86956 6.6028 8.98175 15.5435 11.1054 9.94578 numMergedOcc 0
13 mol 135 unq 0 iso 0 dist 9.94534 11.52 7.02963 14.6255 15.0661 9.40325 numMergedOcc 0
14 mol 135 unq 1 iso 0 dist 9.94534 11.52 7.02963 16.5421 8.72293 8.25527 numMergedOcc 0
15 mol 135 unq 2 iso 0 dist 9.94534 11.52 7.02963 15.8206 6.66299 8.83856 numMergedOcc 0
16 mol 154 unq 0 iso 0 dist 5.97134 4.70993 8.90588 6.28417 4.83835 6.51014 numMergedOcc 0
17 mol 193 unq 0 iso 0 dist 6.17074 5.97706 6.21262 8.76185 5.43768 8.43187 numMergedOcc 0
18 mol 205 unq 0 iso 0 dist 9.81165 10.5686 6.81516 11.2877 4.16557 8.07076 numMergedOcc 0
19 mol 205 unq 1 iso 0 dist 9.81165 10.5686 6.81516 11.6892 7.1653 5.95375 numMergedOcc 0
20 mol 205 unq 2 iso 0 dist 9.81165 10.5686 6.81516 16.3973 11.5523 9.17946 numMergedOcc 0
21 mol 205 unq 3 iso 0 dist 7.74029 10.5686 9.17562 11.2877 8.70828 8.07076 numMergedOcc 0
22 mol 205 unq 4 iso 0 dist 7.74029 10.5686 9.17562 11.6892 6.72925 5.95375 numMergedOcc 0
23 mol 205 unq 5 iso 0 dist 7.74029 10.5686 9.17562 16.3973 10.2944 9.17946 numMergedOcc 0
24 mol 250 unq 0 iso 0 dist 8.73744 7.73342 9.25035 12.4662 11.0798 5.93798 numMergedOcc 0
25 mol 250 unq 1 iso 0 dist 6.61917 5.66455 9.25035 10.7645 11.0798 5.93798 numMergedOcc 0
26 mol 260 unq 0 iso 0 dist 5.30187 4.73121 4.52405 9.15859 9.79316 7.99521 numMergedOcc 0
27 mol 266 unq 0 iso 0 dist 9.50158 6.99137 9.32971 12.1265 5.43106 9.53943 numMergedOcc 0
28 mol 274 unq 0 iso 0 dist 9.85661 4.60275 8.09181 12.4553 13.6012 8.2997 numMergedOcc 0
29 mol 278 unq 0 iso 0 dist 9.94661 11.3687 8.1769 9.80746 8.48896 7.21972 numMergedOcc 0
30 mol 285 unq 0 iso 0 dist 6.01404 4.39689 8.79261 5.80415 8.03918 6.74142 numMergedOcc 0
