0 mol 24 unq 0 iso 0 dist 8.15652 8.56483 9.75636 8.23069 4.93188 8.70827 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 8.15652 8.56483 9.75636 8.59466 9.24958 9.12854 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 8.8533 8.69142 5.30297 10.1933 5.69955 10.177 numMergedOcc 0
3 mol 26 unq 1 iso 0 dist 8.8533 8.69142 5.30297 11.9181 8.6385 7.36856 numMergedOcc 0
4 mol 26 unq 2 iso 0 dist 6.87744 8.43523 5.30297 10.4881 5.69955 10.177 numMergedOcc 0
5 mol 26 unq 3 iso 0 dist 6.87744 8.43523 5.30297 10.4441 8.6385 7.36856 numMergedOcc 0
6 mol 30 unq 0 iso 0 dist 6.40398 5.71014 6.0015 10.9094 8.7817 12.4936 numMergedOcc 0
7 mol 30 unq 1 iso 0 dist 6.40398 5.71014 6.0015 11.8694 7.55415 13.1016 numMergedOcc 0
8 mol 65 unq 0 iso 0 dist 4.76226 9.23452 5.98589 4.8507 5.69971 10.5166 numMergedOcc 0
9 mol 65 unq 1 iso 0 dist 4.76226 9.23452 5.98589 7.51615 9.83239 15.4092 numMergedOcc 0
10 mol 65 unq 2 iso 0 dist 4.76226 9.23452 5.98589 10.2999 8.37515 13.3283 numMergedOcc 0
11 mol 65 unq 3 iso 0 dist 4.76226 8.21365 7.25966 4.8507 5.69971 12.0795 numMergedOcc 0
12 mol 65 unq 4 iso 0 dist 4.76226 8.21365 7.25966 7.51615 9.83239 12.3692 numMergedOcc 0
13 mol 65 unq 5 iso 0 dist 4.76226 8.21365 7.25966 10.2999 8.37515 12.2326 numMergedOcc 0
14 mol 70 unq 0 iso 0 dist 9.33262 5.76805 8.75516 9.9009 9.31969 11.6081 numMergedOcc 0
15 mol 70 unq 1 iso 0 dist 9.33262 5.76805 8.75516 9.66495 6.54023 12.0246 numMergedOcc 0
16 mol 70 unq 2 iso 0 dist 4.67358 6.13606 8.68801 9.17087 9.31969 13.1203 numMergedOcc 0
17 mol 70 unq 3 iso 0 dist 4.67358 6.13606 8.68801 5.33532 6.54023 10.9151 numMergedOcc 0
18 mol 112 unq 0 iso 0 dist 5.9819 8.65004 5.91698 4.9102 6.43433 11.5768 numMergedOcc 0
19 mol 112 unq 1 iso 0 dist 5.9819 8.65004 5.91698 6.84034 9.92283 14.3677 numMergedOcc 0
20 mol 112 unq 2 iso 0 dist 5.9819 9.86487 15.0784 4.9102 6.43433 12.9739 numMergedOcc 0
21 mol 112 unq 3 iso 0 dist 5.9819 9.86487 15.0784 6.84034 9.92283 10.1861 numMergedOcc 0
22 mol 114 unq 0 iso 0 dist 5.36473 9.84391 8.66057 9.04668 9.7918 14.7674 numMergedOcc 0
23 mol 133 unq 0 iso 0 dist 8.37793 9.29665 13.6359 13.2145 6.76699 17.4081 numMergedOcc 0
24 mol 186 unq 0 iso 0 dist 6.59729 8.34668 6.71237 10.2733 6.72641 7.76163 numMergedOcc 0
25 mol 186 unq 1 iso 0 dist 6.59729 8.76308 5.91678 10.2733 6.72641 10.2534 numMergedOcc 0
26 mol 195 unq 0 iso 0 dist 8.22643 5.0778 6.74112 4.98231 6.60567 6.95086 numMergedOcc 0
27 mol 195 unq 1 iso 0 dist 8.22643 5.0778 6.74112 13.577 7.62942 14.0524 numMergedOcc 0
28 mol 198 unq 0 iso 0 dist 5.33789 6.73371 9.86517 9.81415 9.18635 16.2739 numMergedOcc 0
29 mol 198 unq 1 iso 0 dist 5.33789 6.73371 9.86517 5.21925 8.10985 6.34616 numMergedOcc 0
30 mol 209 unq 0 iso 0 dist 6.43914 9.17634 12.5858 5.35615 8.41195 13.9599 numMergedOcc 0
31 mol 230 unq 0 iso 0 dist 6.47064 5.75445 6.0456 10.7614 9.09271 12.7167 numMergedOcc 0
32 mol 230 unq 1 iso 0 dist 6.47064 5.75445 6.0456 11.777 7.44838 13.0012 numMergedOcc 0
33 mol 236 unq 0 iso 0 dist 9.33359 5.27184 5.92456 12.8358 8.50331 12.6259 numMergedOcc 0
34 mol 236 unq 1 iso 0 dist 9.33359 7.98527 10.9807 12.8358 8.50331 15.8016 numMergedOcc 0
35 mol 238 unq 0 iso 0 dist 5.5826 8.85202 6.84212 11.1632 6.66971 10.784 numMergedOcc 0
36 mol 238 unq 1 iso 0 dist 5.5826 8.85202 6.84212 11.0996 6.4398 12.2731 numMergedOcc 0
37 mol 238 unq 2 iso 0 dist 5.5826 8.85202 6.84212 5.18833 7.32982 12.6066 numMergedOcc 0
38 mol 238 unq 3 iso 0 dist 5.5826 6.97527 4.77308 11.1632 6.66971 7.57812 numMergedOcc 0
39 mol 238 unq 4 iso 0 dist 5.5826 6.97527 4.77308 11.0996 6.4398 10.1217 numMergedOcc 0
40 mol 238 unq 5 iso 0 dist 5.5826 6.97527 4.77308 5.18833 7.32982 9.24557 numMergedOcc 0
41 mol 240 unq 0 iso 0 dist 5.46783 4.98994 8.23234 14.5429 9.47583 15.2806 numMergedOcc 0
42 mol 240 unq 1 iso 0 dist 5.46783 4.98994 8.23234 13.8996 8.44909 15.9329 numMergedOcc 0
