File: test1.car

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file content (14 lines) | stat: -rw-r--r-- 1,136 bytes parent folder | download | duplicates (5) 
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!BIOSYM archive 3                                                               
PBC=ON                                                                          
Configurations     : 3                  Configuration Index:  1                 
!DATE Fri Jan 21 10:08:13 2000                                                  
PBC   34.1679   34.1679   34.1679   90.0000   90.0000   90.0000 ( P4 )            
OH      16.921415329   21.073143005   11.147052765 OHH  1      o2*     O  -0.840
HH1     17.083187103   22.015335083   11.234891891 OHH  1      h1o     H   0.420
HH2     17.728298187   20.590099335   11.339980125 OHH  1      h1o     H   0.420
end                                                                             
OH      20.267938614   27.747318268   20.321449280 OHH  1      o2*     O  -0.840
HH1     20.818796158   27.070302963   20.721185684 OHH  1      h1o     H   0.420
HH2     19.378934860   27.406221390   20.199258804 OHH  1      h1o     H   0.420
end                                                                             
end