%chk=000267064.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000267064

0 1
O -3.125681 2.642657 0.747210
O 1.549481 3.073507 -1.086511
N -2.146604 0.111616 0.148986
N 1.953353 0.489584 -0.194723
N -1.717408 1.258946 -0.480425
N 1.257232 1.433270 0.529004
C -2.080798 -2.277435 0.513074
C 2.857468 -1.726698 -0.515433
C -2.576500 -3.287403 -0.544394
C -0.936629 -2.886036 1.351915
C 1.905434 -2.832120 -1.019838
C 3.978745 -2.327566 0.359327
C -1.594526 -1.019220 -0.176902
C 2.075364 -0.709659 0.292527
C -3.816884 -2.786480 -1.277665
C -0.640704 -2.059338 2.599239
C 1.056839 -2.367294 -2.198308
C 5.024515 -1.286488 0.746406
C -0.712857 4.492572 0.098923
C -1.614703 3.672394 -0.831942
C 0.287012 3.645445 0.897248
C -2.262916 2.515816 -0.087643
C 1.098205 2.741740 -0.016354
H -2.934963 -2.027975 1.196336
H 3.329127 -1.224245 -1.400979
H -1.770577 -3.508160 -1.270593
H -2.806551 -4.250896 -0.047290
H -0.016137 -2.988577 0.729486
H -1.209162 -3.917724 1.650482
H 2.496877 -3.720064 -1.318118
H 1.239917 -3.173542 -0.191196
H 3.550852 -2.791037 1.268702
H 4.468904 -3.152503 -0.195998
H -0.792125 -1.176554 -0.923642
H 1.675694 -1.081160 1.245316
H -4.646390 -2.596208 -0.584988
H -4.164851 -3.515635 -2.017119
H -3.624505 -1.844109 -1.805124
H -1.490471 -2.069104 3.294919
H 0.228639 -2.446715 3.140449
H -0.453265 -1.007681 2.354237
H 1.672643 -1.949837 -3.004764
H 0.347027 -1.578298 -1.894775
H 0.475215 -3.192693 -2.623200
H 4.586763 -0.465044 1.326117
H 5.492262 -0.835682 -0.138038
H 5.823100 -1.730073 1.351060
H -0.160254 5.238025 -0.512829
H -1.339905 5.068733 0.811906
H -2.425029 4.320706 -1.232044
H -1.036139 3.350225 -1.723398
H -0.253635 3.087302 1.689784
H 0.991709 4.314777 1.437982
H -0.976845 1.222585 -1.196446
H 0.821334 1.193951 1.428441


%chk=000267064-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000267064

0 1
O -2.461069 2.542351 1.302571
O 1.779082 3.242464 -1.309540
N -2.488293 -0.078227 0.243120
N 2.513239 0.731929 -0.229306
N -2.005896 1.036398 -0.442766
N 1.714012 1.664933 0.431451
C -2.879030 -2.503920 0.316256
C 3.576846 -1.486314 -0.257447
C -3.925754 -3.221214 -0.587470
C -1.687958 -3.455843 0.644374
C 2.714779 -2.743592 -0.587300
C 4.763475 -1.862094 0.679519
C -2.383782 -1.241218 -0.349935
C 2.726182 -0.409824 0.376053
C -5.206325 -2.394964 -0.830302
C -0.701694 -2.879523 1.681885
C 1.627542 -2.487075 -1.651840
C 5.759169 -0.706057 0.911446
C -0.633921 4.443826 -0.043594
C -1.516115 3.416492 -0.794783
C 0.536501 3.797531 0.739320
C -2.043749 2.317138 0.135985
C 1.401239 2.902728 -0.157287
H -3.367093 -2.207536 1.265660
H 3.981628 -1.075726 -1.203411
H -3.451928 -3.478653 -1.558042
H -4.191480 -4.184074 -0.107467
H -1.148026 -3.701963 -0.293570
H -2.107852 -4.409341 1.022192
H 3.397418 -3.542500 -0.939422
H 2.247948 -3.120588 0.346222
H 4.360940 -2.215641 1.651965
H 5.294461 -2.725315 0.231380
H -1.929654 -1.365412 -1.360003
H 2.298054 -0.650322 1.376595
H -5.709085 -2.154800 0.124707
H -5.923030 -2.949927 -1.462743
H -4.980775 -1.436499 -1.332355
H -1.219250 -2.642680 2.629683
H 0.105760 -3.601596 1.903934
H -0.237014 -1.945218 1.316427
H 2.077128 -2.135210 -2.598613
H 0.914745 -1.711188 -1.316441
H 1.056741 -3.409673 -1.865814
H 5.266056 0.165510 1.379259
H 6.194622 -0.362243 -0.044942
H 6.588734 -1.021972 1.569952
H -0.228422 5.155933 -0.784020
H -1.257539 5.006970 0.673047
H -2.391580 3.942896 -1.223042
H -0.947915 2.990666 -1.643501
H 0.137309 3.240536 1.607564
H 1.185887 4.601044 1.137735
H -1.597944 0.934317 -1.385215
H 1.319374 1.448877 1.360265


