0 mol 26 unq 0 iso 0 dist 9.15677 12.1626 9.7522 16.4682 8.34347 15.0931 15.7188 6.73162 11.7823 7.23546 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 9.61029 7.53125 9.7522 14.3476 8.34347 15.0931 7.95969 6.73162 11.7823 7.23546 numMergedOcc 0
2 mol 54 unq 0 iso 0 dist 7.51978 8.88887 5.97635 10.6355 9.5589 10.7219 5.59128 5.02241 8.98505 6.91765 numMergedOcc 0
3 mol 54 unq 1 iso 0 dist 7.51978 8.88887 5.97635 6.43082 6.83299 6.76462 5.59128 5.02241 8.98505 5.06052 numMergedOcc 0
4 mol 54 unq 2 iso 0 dist 7.51978 8.88887 5.97635 11.7347 8.10861 13.2619 5.59128 5.02241 8.98505 10.1332 numMergedOcc 0
5 mol 59 unq 0 iso 0 dist 7.67586 5.74095 6.65344 5.03832 6.85766 5.29688 10.9894 6.71911 10.4897 7.29033 numMergedOcc 0
6 mol 59 unq 1 iso 0 dist 7.67586 5.74095 6.65344 11.7065 7.71095 13.1729 10.9894 6.71911 10.4897 5.33688 numMergedOcc 0
7 mol 59 unq 2 iso 0 dist 8.97292 6.00486 6.65344 7.2878 6.85766 5.29688 9.55542 6.71911 10.4897 7.29033 numMergedOcc 0
8 mol 59 unq 3 iso 0 dist 8.97292 6.00486 6.65344 14.1347 7.71095 13.1729 9.55542 6.71911 10.4897 5.33688 numMergedOcc 0
9 mol 86 unq 0 iso 0 dist 7.26032 4.4104 8.88225 5.91309 9.5497 8.73453 11.9674 7.79359 14.1743 9.68893 numMergedOcc 0
10 mol 86 unq 1 iso 0 dist 7.26032 9.78656 9.49308 5.91309 9.5497 10.7693 11.9674 7.79359 12.091 9.68893 numMergedOcc 0
11 mol 86 unq 2 iso 0 dist 5.49793 9.86291 8.88225 5.82069 9.5497 8.73453 4.51657 7.79359 14.1743 9.68893 numMergedOcc 0
12 mol 86 unq 3 iso 0 dist 5.49793 9.22136 9.49308 5.82069 9.5497 10.7693 4.51657 7.79359 12.091 9.68893 numMergedOcc 0
13 mol 205 unq 0 iso 0 dist 7.36642 7.49505 5.96555 4.87114 6.03031 4.6995 7.13867 9.19704 12.5517 8.66809 numMergedOcc 0
14 mol 205 unq 1 iso 0 dist 7.36642 7.49505 5.96555 9.43922 7.26832 10.7091 7.13867 9.19704 12.5517 6.23291 numMergedOcc 0
15 mol 205 unq 2 iso 0 dist 7.36642 7.49505 5.96555 6.98312 7.80463 5.87892 7.13867 9.19704 12.5517 13.231 numMergedOcc 0
16 mol 214 unq 0 iso 0 dist 6.83122 6.06185 9.51764 9.3424 9.65138 6.28065 8.77336 6.97182 6.09245 6.16485 numMergedOcc 0
17 mol 214 unq 1 iso 0 dist 6.83122 6.06185 9.51764 9.3424 9.65138 6.28065 10.8541 6.1175 10.8345 11.5712 numMergedOcc 0
18 mol 214 unq 2 iso 0 dist 6.83122 6.06185 9.51764 12.2622 7.14453 11.2159 8.77336 6.97182 6.09245 5.33565 numMergedOcc 0
19 mol 214 unq 3 iso 0 dist 6.83122 6.06185 9.51764 12.2622 7.14453 11.2159 10.8541 6.1175 10.8345 5.06792 numMergedOcc 0
20 mol 214 unq 4 iso 0 dist 6.83122 6.06185 9.51764 6.75833 8.85478 6.53326 8.77336 6.97182 6.09245 8.47007 numMergedOcc 0
21 mol 214 unq 5 iso 0 dist 6.83122 6.06185 9.51764 6.75833 8.85478 6.53326 10.8541 6.1175 10.8345 12.8334 numMergedOcc 0
22 mol 214 unq 6 iso 0 dist 6.83122 12.1024 5.36829 9.3424 9.65138 11.7583 8.77336 6.97182 8.69149 6.16485 numMergedOcc 0
23 mol 214 unq 7 iso 0 dist 6.83122 12.1024 5.36829 9.3424 9.65138 11.7583 10.8541 6.1175 6.00706 11.5712 numMergedOcc 0
24 mol 214 unq 8 iso 0 dist 6.83122 12.1024 5.36829 12.2622 7.14453 4.98764 8.77336 6.97182 8.69149 5.33565 numMergedOcc 0
25 mol 214 unq 9 iso 0 dist 6.83122 12.1024 5.36829 12.2622 7.14453 4.98764 10.8541 6.1175 6.00706 5.06792 numMergedOcc 0
26 mol 214 unq 10 iso 0 dist 6.83122 12.1024 5.36829 6.75833 8.85478 12.3481 8.77336 6.97182 8.69149 8.47007 numMergedOcc 0
27 mol 214 unq 11 iso 0 dist 6.83122 12.1024 5.36829 6.75833 8.85478 12.3481 10.8541 6.1175 6.00706 12.8334 numMergedOcc 0
28 mol 238 unq 0 iso 0 dist 9.82174 11.6082 6.24928 10.4397 6.57393 5.33567 12.5765 6.91569 6.66018 10.9761 numMergedOcc 0
29 mol 249 unq 0 iso 0 dist 6.42827 7.26569 6.37672 8.22485 7.57994 9.07501 5.63238 8.83735 10.4294 5.23473 numMergedOcc 0
30 mol 249 unq 1 iso 0 dist 6.42827 7.26569 6.37672 6.77698 6.18582 4.24014 5.63238 8.83735 10.4294 7.38675 numMergedOcc 0
31 mol 249 unq 2 iso 0 dist 6.42827 6.09915 8.94023 8.22485 7.57994 9.53929 5.63238 8.83735 9.10124 5.23473 numMergedOcc 0
32 mol 249 unq 3 iso 0 dist 6.42827 6.09915 8.94023 6.77698 6.18582 5.36989 5.63238 8.83735 9.10124 7.38675 numMergedOcc 0
33 mol 253 unq 0 iso 0 dist 5.76077 5.03278 5.89502 9.0081 9.02271 9.25001 10.6548 7.19465 11.889 7.92528 numMergedOcc 0
34 mol 253 unq 1 iso 0 dist 5.76077 4.58695 7.15815 9.0081 9.02271 4.93871 10.6548 7.19465 8.75798 7.92528 numMergedOcc 0
35 mol 253 unq 2 iso 0 dist 7.0247 12.6079 5.89502 10.9027 9.02271 9.25001 3.494 7.19465 11.889 7.92528 numMergedOcc 0
36 mol 253 unq 3 iso 0 dist 7.0247 11.088 7.15815 10.9027 9.02271 4.93871 3.494 7.19465 8.75798 7.92528 numMergedOcc 0
37 mol 265 unq 0 iso 0 dist 4.96568 9.37522 9.772 5.25115 8.4218 5.75478 6.67645 6.34034 5.55314 6.43013 numMergedOcc 0
38 mol 272 unq 0 iso 0 dist 7.22438 7.51377 9.96394 10.3544 8.33638 11.5918 6.68919 6.73206 5.98845 5.63139 numMergedOcc 0
