%chk=000200650.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000200650

1 1
O -1.646096 1.075962 1.100434
O -1.225295 0.874357 -1.098587
N -4.374206 -0.678370 -0.009911
C 1.639814 1.520446 -0.167337
C 3.057414 1.228795 0.359243
C 1.288582 3.008755 0.024396
C 0.604506 0.618746 0.571902
C 4.089673 2.121212 -0.343111
C 2.321281 3.900595 -0.680760
C 3.743822 3.607465 -0.187137
C 0.904870 -0.856851 0.415745
C -0.779426 0.867869 0.025466
C -3.865661 0.142003 1.178148
C -3.029386 1.376369 0.823236
C 1.230706 -1.618649 1.546664
C 0.872389 -1.462633 -0.849703
C -5.277074 -1.772314 0.526299
C -3.231204 -1.315692 -0.761204
C -5.169870 0.195872 -0.953112
C 1.525857 -2.978459 1.409148
C 1.168494 -2.821223 -0.980195
C 1.494601 -3.581513 0.148129
H 1.605269 1.278887 -1.258776
H 3.315299 0.163713 0.199250
H 3.104582 1.395283 1.452231
H 1.261011 3.261303 1.101947
H 0.282248 3.228547 -0.375814
H 0.620739 0.897036 1.663065
H 5.097098 1.923004 0.071563
H 4.149301 1.858905 -1.417346
H 2.265776 3.749605 -1.776560
H 2.074920 4.965898 -0.508524
H 3.845442 3.908896 0.873359
H 4.472059 4.224996 -0.747463
H -3.243411 -0.517557 1.840352
H -4.740880 0.455236 1.797397
H -3.149617 1.730717 -0.220092
H -3.243337 2.212416 1.525397
H 1.273346 -1.155430 2.531989
H 0.633673 -0.868828 -1.733851
H -5.682047 -2.404074 -0.288191
H -4.735107 -2.448491 1.215285
H -6.144632 -1.362487 1.076382
H -2.542555 -1.860850 -0.089082
H -2.612055 -0.555257 -1.299256
H -3.583917 -2.029168 -1.527444
H -5.592016 -0.387506 -1.794301
H -4.536862 0.987223 -1.406387
H -6.013264 0.695170 -0.442199
H 1.792119 -3.567203 2.288121
H 1.160160 -3.287071 -1.966166
H 1.736563 -4.639556 0.042660


%chk=000200650-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000200650

1 1
O -1.685322 1.081115 1.274886
O -1.310597 1.083984 -1.024002
N -4.198974 -0.766872 0.143648
C 1.594001 1.593846 -0.208761
C 3.052062 1.248760 0.187000
C 1.291130 3.085868 0.091398
C 0.583782 0.658125 0.536355
C 4.062943 2.186996 -0.515727
C 2.300470 4.024978 -0.611323
C 3.756029 3.674404 -0.225298
C 0.801759 -0.843636 0.274269
C -0.844689 0.980318 0.136279
C -4.078104 0.314941 1.251865
C -3.093223 1.467652 1.034151
C 1.042351 -1.723799 1.358917
C 0.768384 -1.367776 -1.045189
C -5.452939 -1.588486 0.455843
C -2.991462 -1.711103 0.144975
C -4.347898 -0.131758 -1.241359
C 1.259603 -3.102557 1.131778
C 0.984892 -2.745431 -1.272193
C 1.230910 -3.617690 -0.184910
H 1.474244 1.428851 -1.300029
H 3.278238 0.194862 -0.060784
H 3.163136 1.353227 1.287430
H 1.343871 3.250575 1.188725
H 0.261449 3.345217 -0.228814
H 0.669030 0.842533 1.622812
H 5.090041 1.935718 -0.190672
H 4.023568 2.012148 -1.610688
H 2.180277 3.933815 -1.710343
H 2.076064 5.077021 -0.352166
H 3.907909 3.876872 0.854925
H 4.462646 4.324318 -0.774603
H -3.831182 -0.224106 2.182604
H -5.089416 0.748327 1.355552
H -3.187928 1.940078 0.041877
H -3.314927 2.219607 1.810687
H 1.080881 -1.327590 2.380745
H 0.584472 -0.697428 -1.892847
H -5.530615 -2.411991 -0.269939
H -5.372053 -1.998163 1.474531
H -6.340081 -0.941266 0.380078
H -2.857128 -2.123294 1.156189
H -2.090551 -1.170004 -0.165244
H -3.188728 -2.525035 -0.569741
H -4.578418 -0.929738 -1.963986
H -3.403409 0.363082 -1.516200
H -5.175573 0.594448 -1.215533
H 1.463967 -3.768611 1.977035
H 0.976741 -3.136241 -2.295676
H 1.412062 -4.683016 -0.363228


