0 mol 8 unq 0 iso 0 dist 6.27477 9.69819 10.3253 6.1146 7.8922 13.2615 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 9.15677 9.53735 10.797 14.1383 8.44506 11.5353 numMergedOcc 0
2 mol 26 unq 1 iso 0 dist 9.61029 9.34599 10.797 9.77186 8.44506 11.5353 numMergedOcc 0
3 mol 26 unq 2 iso 0 dist 9.61029 6.32127 10.9837 9.77186 8.44506 9.5053 numMergedOcc 0
4 mol 44 unq 0 iso 0 dist 7.16036 9.52676 4.55437 9.32021 7.52117 7.03307 numMergedOcc 0
5 mol 65 unq 0 iso 0 dist 9.9997 9.68286 5.51708 5.23119 9.14931 11.606 numMergedOcc 0
6 mol 65 unq 1 iso 0 dist 9.38611 8.58416 6.47381 5.39637 8.37515 11.2032 numMergedOcc 0
7 mol 68 unq 0 iso 0 dist 6.6606 8.14607 9.12845 5.6194 7.9814 13.1333 numMergedOcc 0
8 mol 76 unq 0 iso 0 dist 8.28737 6.25276 4.3931 6.38454 4.79949 6.66954 numMergedOcc 0
9 mol 76 unq 1 iso 0 dist 8.28737 6.25276 4.3931 11.5407 7.27693 11.1126 numMergedOcc 0
10 mol 100 unq 0 iso 0 dist 5.09688 8.22984 9.75737 5.25231 9.00544 12.2657 numMergedOcc 0
11 mol 100 unq 1 iso 0 dist 5.09688 8.22984 9.75737 6.16378 7.12017 9.5669 numMergedOcc 0
12 mol 100 unq 2 iso 0 dist 9.26343 6.6157 9.75737 8.90536 9.00544 12.2657 numMergedOcc 0
13 mol 100 unq 3 iso 0 dist 9.26343 6.6157 9.75737 5.69359 7.12017 9.5669 numMergedOcc 0
14 mol 112 unq 0 iso 0 dist 7.65229 6.73172 5.39346 12.468 8.729 9.77017 numMergedOcc 0
15 mol 131 unq 0 iso 0 dist 6.38977 8.74658 7.7567 6.53994 8.86329 5.56627 numMergedOcc 0
16 mol 131 unq 1 iso 0 dist 9.69757 8.74658 8.23791 6.53994 8.71039 5.56627 numMergedOcc 0
17 mol 131 unq 2 iso 0 dist 9.69757 8.74658 8.23791 13.4383 6.92648 8.50562 numMergedOcc 0
18 mol 141 unq 0 iso 0 dist 4.93035 9.14007 7.42649 5.74529 6.69515 6.94988 numMergedOcc 0
19 mol 141 unq 1 iso 0 dist 9.75558 9.14007 9.43674 5.74529 7.86572 6.94988 numMergedOcc 0
20 mol 148 unq 0 iso 0 dist 7.38138 9.92375 4.99768 3.97123 7.97543 11.5523 numMergedOcc 0
21 mol 181 unq 0 iso 0 dist 9.25528 5.6688 5.6044 6.09526 6.51749 7.11785 numMergedOcc 0
22 mol 192 unq 0 iso 0 dist 9.05666 7.27051 12.717 6.93447 7.24199 10.3117 numMergedOcc 0
23 mol 192 unq 1 iso 0 dist 9.05666 7.35424 14.8459 6.93447 7.24199 12.6156 numMergedOcc 0
24 mol 196 unq 0 iso 0 dist 6.64506 5.21339 9.09988 11.9967 8.20691 10.7927 numMergedOcc 0
25 mol 196 unq 1 iso 0 dist 6.64506 5.21339 9.09988 5.39297 5.85777 10.0152 numMergedOcc 0
26 mol 204 unq 0 iso 0 dist 7.92766 6.21588 5.86489 10.2224 6.85441 5.91727 numMergedOcc 0
27 mol 227 unq 0 iso 0 dist 6.18486 5.87056 9.32448 5.98086 5.87815 11.5062 numMergedOcc 0
28 mol 227 unq 1 iso 0 dist 6.18486 9.84311 6.48027 5.98086 5.87815 11.0303 numMergedOcc 0
29 mol 227 unq 2 iso 0 dist 6.18486 8.85568 6.67321 5.98086 5.87815 7.95359 numMergedOcc 0
30 mol 238 unq 0 iso 0 dist 9.29203 8.03226 10.3871 10.4401 6.66971 12.8056 numMergedOcc 0
31 mol 238 unq 1 iso 0 dist 7.62771 8.03226 6.54814 10.4401 6.4398 12.8056 numMergedOcc 0
32 mol 238 unq 2 iso 0 dist 7.80166 8.03226 14.388 10.4401 7.32982 12.8056 numMergedOcc 0
33 mol 253 unq 0 iso 0 dist 5.76077 7.06589 5.78064 5.37783 7.77998 8.15091 numMergedOcc 0
34 mol 253 unq 1 iso 0 dist 7.0247 8.70383 5.78064 14.5125 7.77998 8.15091 numMergedOcc 0
