0 mol 1 unq 0 iso 0 dist 8.61411 5.55519 5.74199 13.4579 10.4572 8.69605 numMergedOcc 0
1 mol 7 unq 0 iso 0 dist 9.84857 7.62195 8.41173 13.472 10.1841 7.38748 numMergedOcc 0
2 mol 10 unq 0 iso 0 dist 7.99404 8.20812 8.99402 16.2216 17.1926 9.78153 numMergedOcc 0
3 mol 37 unq 0 iso 0 dist 8.98177 9.45747 9.25986 14.9484 9.16636 7.65802 numMergedOcc 0
4 mol 76 unq 0 iso 0 dist 9.06225 8.04327 7.02854 8.92491 5.22567 5.73235 numMergedOcc 0
5 mol 79 unq 0 iso 0 dist 8.71103 6.05149 7.41952 5.55798 9.57704 8.64686 numMergedOcc 0
6 mol 90 unq 0 iso 0 dist 9.28585 4.59148 6.6146 13.0735 5.12529 9.06641 numMergedOcc 0
7 mol 99 unq 0 iso 0 dist 5.33644 6.02095 6.81741 5.61946 4.74328 8.68674 numMergedOcc 0
8 mol 129 unq 0 iso 0 dist 8.63018 5.0466 7.07421 6.65878 5.06265 7.6453 numMergedOcc 0
9 mol 133 unq 0 iso 0 dist 6.85651 8.75242 9.07294 6.9268 5.35551 5.79195 numMergedOcc 0
10 mol 133 unq 1 iso 0 dist 6.85651 14.0828 7.50126 6.9268 5.35551 9.2759 numMergedOcc 0
11 mol 133 unq 2 iso 0 dist 7.03858 6.45333 9.07294 8.19166 5.35551 5.79195 numMergedOcc 0
12 mol 133 unq 3 iso 0 dist 7.03858 11.5586 7.50126 8.19166 5.35551 9.2759 numMergedOcc 0
13 mol 133 unq 4 iso 0 dist 5.68599 5.57746 5.12189 11.9103 10.8516 9.2759 numMergedOcc 0
14 mol 134 unq 0 iso 0 dist 9.49104 8.22726 5.33543 15.9043 10.6104 9.88178 numMergedOcc 0
15 mol 147 unq 0 iso 0 dist 8.52428 7.75436 9.13646 5.47265 4.61905 5.32865 numMergedOcc 0
16 mol 148 unq 0 iso 0 dist 9.22427 14.778 9.71692 13.508 11.8278 9.18753 numMergedOcc 0
17 mol 150 unq 0 iso 0 dist 9.32504 14.922 9.73708 13.5808 11.6537 9.15244 numMergedOcc 0
18 mol 162 unq 0 iso 0 dist 8.77869 15.3374 8.954 16.3072 7.84996 6.59407 numMergedOcc 0
19 mol 183 unq 0 iso 0 dist 7.38821 4.0252 7.69421 7.99897 6.39127 8.29364 numMergedOcc 0
20 mol 183 unq 1 iso 0 dist 7.38821 4.0252 7.69421 11.0442 9.01399 8.97652 numMergedOcc 0
21 mol 186 unq 0 iso 0 dist 9.89709 12.6035 7.02662 6.36789 6.12748 6.72718 numMergedOcc 0
22 mol 186 unq 1 iso 0 dist 9.89709 12.6035 7.02662 15.9248 8.01622 8.72949 numMergedOcc 0
23 mol 186 unq 2 iso 0 dist 9.12583 10.2313 9.94142 13.5305 8.05438 8.46819 numMergedOcc 0
24 mol 192 unq 0 iso 0 dist 7.252 13.2525 7.30965 9.78743 5.21255 6.2016 numMergedOcc 0
25 mol 192 unq 1 iso 0 dist 7.252 13.2525 7.30965 11.7278 5.1366 8.3453 numMergedOcc 0
26 mol 204 unq 0 iso 0 dist 7.19213 5.55359 7.00683 13.5496 8.61406 9.52029 numMergedOcc 0
27 mol 204 unq 1 iso 0 dist 5.67196 4.72843 7.00683 10.6489 8.61406 9.52029 numMergedOcc 0
28 mol 217 unq 0 iso 0 dist 8.79299 4.10975 6.01666 7.80898 5.16489 7.60302 numMergedOcc 0
29 mol 220 unq 0 iso 0 dist 8.65696 9.42128 8.98362 11.7804 5.82963 6.50756 numMergedOcc 0
30 mol 226 unq 0 iso 0 dist 8.10096 6.92911 7.20862 15.606 12.3908 8.74399 numMergedOcc 0
31 mol 239 unq 0 iso 0 dist 8.68803 6.54316 9.59937 4.53228 5.94643 7.58554 numMergedOcc 0
32 mol 241 unq 0 iso 0 dist 8.15897 6.70277 9.174 12.5814 10.9643 7.26758 numMergedOcc 0
33 mol 244 unq 0 iso 0 dist 6.06284 5.45847 6.51428 9.80233 4.69664 7.43391 numMergedOcc 0
34 mol 244 unq 1 iso 0 dist 6.06284 5.45847 6.51428 12.6281 13.4155 7.79787 numMergedOcc 0
35 mol 245 unq 0 iso 0 dist 8.91609 6.62389 6.41862 15.8013 14.6391 9.96585 numMergedOcc 0
36 mol 245 unq 1 iso 0 dist 8.91609 6.62389 6.41862 13.7695 10.1523 7.27022 numMergedOcc 0
37 mol 245 unq 2 iso 0 dist 8.91609 6.62389 6.41862 10.9742 3.53109 7.95061 numMergedOcc 0
38 mol 245 unq 3 iso 0 dist 6.58637 5.43086 6.41862 15.2251 14.6391 9.96585 numMergedOcc 0
39 mol 245 unq 4 iso 0 dist 6.58637 5.43086 6.41862 12.3939 10.1523 7.27022 numMergedOcc 0
40 mol 245 unq 5 iso 0 dist 6.58637 5.43086 6.41862 9.59668 3.53109 7.95061 numMergedOcc 0
41 mol 245 unq 6 iso 0 dist 5.48167 5.43086 8.69377 15.2251 17.4904 9.96585 numMergedOcc 0
42 mol 245 unq 7 iso 0 dist 5.48167 5.43086 8.69377 12.3939 13.6404 7.27022 numMergedOcc 0
43 mol 245 unq 8 iso 0 dist 5.48167 5.43086 8.69377 9.59668 9.71014 7.95061 numMergedOcc 0
44 mol 258 unq 0 iso 0 dist 9.4886 12.1075 8.57305 11.4159 5.00751 6.33567 numMergedOcc 0
45 mol 259 unq 0 iso 0 dist 7.97113 6.92619 8.91916 11.0717 6.40534 8.54422 numMergedOcc 0
46 mol 259 unq 1 iso 0 dist 7.97113 6.92619 8.91916 10.5924 9.57286 7.67473 numMergedOcc 0
47 mol 259 unq 2 iso 0 dist 5.22111 6.92619 4.55368 11.0717 6.14631 8.54422 numMergedOcc 0
48 mol 259 unq 3 iso 0 dist 5.22111 6.92619 4.55368 10.5924 6.89689 7.67473 numMergedOcc 0
49 mol 259 unq 4 iso 0 dist 8.38479 11.3266 8.91916 13.7519 6.40534 8.54422 numMergedOcc 0
50 mol 259 unq 5 iso 0 dist 8.38479 11.3266 8.91916 14.6605 9.57286 7.67473 numMergedOcc 0
51 mol 259 unq 6 iso 0 dist 8.53598 11.3266 4.55368 13.7519 6.14631 8.54422 numMergedOcc 0
52 mol 259 unq 7 iso 0 dist 8.53598 11.3266 4.55368 14.6605 6.89689 7.67473 numMergedOcc 0
53 mol 265 unq 0 iso 0 dist 8.22353 5.62902 9.50814 8.01664 3.89234 7.52632 numMergedOcc 0
54 mol 274 unq 0 iso 0 dist 7.62562 10.4456 6.12202 16.7249 10.3702 9.34051 numMergedOcc 0
55 mol 277 unq 0 iso 0 dist 7.52227 9.59994 8.81903 9.78915 4.81768 8.04712 numMergedOcc 0
56 mol 283 unq 0 iso 0 dist 7.90132 5.37953 7.53773 12.7983 6.85055 9.243 numMergedOcc 0
57 mol 294 unq 0 iso 0 dist 8.82869 4.75799 5.76337 10.4239 7.87494 9.77023 numMergedOcc 0
