%chk=000289940.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000289940

0 1
O 0.199109 -1.687709 1.614556
O -2.646052 -2.026659 0.806704
O 6.553842 0.663490 0.669686
N -2.285195 0.187526 0.214401
N 0.051308 -1.936474 -0.815620
N 0.912869 -1.103875 -1.619461
C 0.135239 0.291011 0.240339
C -0.347313 -1.177666 0.412937
C -1.143777 1.112187 -0.043123
C 1.137406 0.228938 -0.939614
C -3.699926 0.644452 0.181387
C -1.903268 -1.119789 0.496800
C -3.957137 1.701937 1.275051
C -4.063743 1.190022 -1.214997
C 2.573145 0.303961 -0.469862
C -5.427763 2.138181 1.243958
C -5.534609 1.626398 -1.237368
C -5.828230 2.661690 -0.142514
C 0.733149 -3.232486 -0.523127
C 3.442210 1.240970 -1.058664
C 3.054748 -0.554681 0.526921
C 4.767573 1.333825 -0.650427
C 4.383208 -0.482995 0.955343
C 5.226037 0.462872 0.359766
C 7.147562 -0.185234 1.681031
H 0.629374 0.644212 1.173788
H -1.210058 1.997581 0.623291
H -1.181149 1.480301 -1.090019
H 0.941266 1.056206 -1.666412
H -4.330949 -0.266027 0.396183
H 0.401946 -0.957971 -2.509441
H -3.301590 2.580282 1.131355
H -3.702462 1.286913 2.268775
H -3.883740 0.413177 -1.982308
H -3.415470 2.044374 -1.481836
H -5.601510 2.919509 2.007647
H -6.078327 1.287317 1.526801
H -6.190838 0.743633 -1.105872
H -5.784927 2.044849 -2.230351
H -6.903255 2.922159 -0.149917
H -5.284544 3.600971 -0.359591
H -0.313503 -2.476704 1.926304
H 1.565553 -3.157467 0.194391
H 1.136694 -3.646295 -1.463708
H -0.026673 -3.932510 -0.139675
H 3.080612 1.902454 -1.845724
H 2.382207 -1.291120 0.981090
H 5.454350 2.051571 -1.091601
H 4.737375 -1.154345 1.729493
H 8.179695 0.187694 1.709109
H 7.117720 -1.231763 1.364462
H 6.650009 -0.034990 2.643265


%chk=000289940-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000289940

0 1
O 0.351925 -1.667636 1.553547
O -2.454765 -1.908563 1.135017
O 6.817622 0.267478 0.647915
N -2.244473 0.317909 0.330180
N 0.049290 -1.574188 -0.901635
N 0.825506 -0.622402 -1.715556
C 0.162258 0.512391 0.299136
C -0.260781 -0.973047 0.429753
C -1.162908 1.232712 -0.105679
C 1.240182 0.531457 -0.822978
C -3.682300 0.660492 0.301057
C -1.785075 -0.934232 0.670370
C -4.019268 1.868350 1.210677
C -4.186714 0.896418 -1.146300
C 2.690253 0.439198 -0.357737
C -5.542681 2.148180 1.200377
C -5.709046 1.177464 -1.155289
C -6.068006 2.370951 -0.238027
C 0.603407 -2.944598 -0.912619
C 3.685238 1.155353 -1.075724
C 3.102605 -0.358333 0.737192
C 5.043711 1.082146 -0.722518
C 4.464643 -0.445762 1.105184
C 5.439146 0.275725 0.373277
C 7.276778 -0.561494 1.763746
H 0.530211 0.881956 1.268152
H -1.260065 2.215834 0.387493
H -1.208679 1.392234 -1.202630
H 1.143070 1.452669 -1.430678
H -4.192087 -0.236467 0.707577
H 0.187375 -0.271309 -2.450325
H -3.486491 2.772054 0.848520
H -3.667510 1.667090 2.240108
H -3.951026 0.011914 -1.767717
H -3.654962 1.764679 -1.588588
H -5.765248 3.029477 1.831923
H -6.074248 1.287002 1.654630
H -6.247368 0.272866 -0.805400
H -6.049321 1.371018 -2.190547
H -7.164189 2.523569 -0.222978
H -5.620455 3.298475 -0.652091
H -0.337405 -2.300445 1.901449
H 1.615473 -3.012433 -0.467737
H 0.646523 -3.290208 -1.957915
H -0.083910 -3.605812 -0.356616
H 3.391176 1.776503 -1.931475
H 2.362206 -0.927454 1.309568
H 5.811305 1.633984 -1.273628
H 4.747527 -1.074034 1.955411
H 8.368094 -0.426319 1.792692
H 7.037432 -1.630109 1.597896
H 6.834226 -0.228801 2.723138


