%chk=000179191.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000179191

0 1
O 3.204540 2.476971 -1.192464
O -2.802267 -0.308644 0.410912
N 2.285367 0.376650 -1.240247
C 3.266950 -0.725752 0.828127
C 3.477027 -0.275824 -0.651402
C 4.607124 -1.299822 1.325371
C 2.864550 0.475394 1.695791
C 2.185005 -1.817471 0.906151
C 2.221346 1.770618 -1.326214
C 0.848950 2.330833 -1.685192
C -0.139604 2.070000 -0.586577
C -0.990187 0.956503 -0.662585
C -0.190307 2.921315 0.526609
C -1.868266 0.724591 0.399671
C -1.096014 2.671965 1.564619
C -1.944118 1.566114 1.520553
C -2.514351 -1.508015 -0.246750
C -1.246862 -2.098864 -0.244690
C -3.636836 -2.123584 -0.820747
C -1.107397 -3.353753 -0.845208
C -3.468477 -3.377524 -1.408281
C -2.208430 -3.990586 -1.426183
H 3.739009 -1.150086 -1.285576
H 4.340095 0.431660 -0.709438
H 4.939172 -2.149005 0.720472
H 5.401361 -0.545140 1.304254
H 4.527911 -1.650386 2.360248
H 2.850686 0.216420 2.759036
H 3.562975 1.312506 1.569226
H 1.867651 0.852219 1.441083
H 2.088974 -2.199524 1.929343
H 2.422842 -2.669830 0.262913
H 1.192488 -1.441721 0.617127
H 1.428691 -0.170570 -1.206665
H 0.505840 1.921705 -2.658076
H 0.959872 3.425484 -1.866216
H -0.989749 0.306310 -1.533291
H 0.478615 3.779153 0.586031
H -1.133475 3.346117 2.421805
H -2.650923 1.349298 2.318043
H -0.392438 -1.608306 0.229835
H -4.604077 -1.626240 -0.792884
H -0.131359 -3.839114 -0.854217
H -4.324098 -3.881009 -1.859123
H -2.088609 -4.967055 -1.890992


%chk=000179191-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000179191

0 1
O 3.002159 1.338622 -2.094416
O -3.430623 -0.649445 0.013565
N 2.182964 0.213009 -0.222955
C 4.182291 -0.115354 1.325571
C 3.410473 -0.552142 0.039834
C 5.432809 -1.025696 1.442140
C 4.619324 1.365817 1.204749
C 3.288185 -0.303088 2.579942
C 2.068690 1.110647 -1.266287
C 0.710937 1.849716 -1.392690
C -0.357894 1.502168 -0.371256
C -1.362850 0.551333 -0.683171
C -0.362367 2.115128 0.910575
C -2.346756 0.221532 0.277634
C -1.356987 1.782441 1.858713
C -2.353791 0.832353 1.551746
C -3.324789 -1.700166 -0.936652
C -2.171889 -2.511462 -1.051761
C -4.484590 -1.968230 -1.695222
C -2.185793 -3.596199 -1.956518
C -4.485642 -3.059921 -2.591286
C -3.337241 -3.874474 -2.730001
H 3.154991 -1.628150 0.123426
H 4.057612 -0.417133 -0.845242
H 5.148378 -2.092354 1.526343
H 6.089775 -0.915014 0.558990
H 6.024213 -0.762649 2.338638
H 5.178542 1.681610 2.105420
H 5.266134 1.518098 0.321666
H 3.742954 2.030578 1.095299
H 3.853171 -0.058822 3.498608
H 2.936184 -1.349261 2.669977
H 2.402123 0.360085 2.553644
H 1.382571 0.100947 0.403035
H 0.358134 1.652177 -2.421043
H 0.956313 2.927310 -1.354889
H -1.384336 0.087258 -1.674873
H 0.400940 2.862815 1.155672
H -1.359449 2.266951 2.841141
H -3.136949 0.564282 2.266686
H -1.287382 -2.308314 -0.439947
H -5.361184 -1.325632 -1.570588
H -1.296008 -4.228615 -2.049316
H -5.383473 -3.270895 -3.182377
H -3.340676 -4.717859 -3.428320


