%chk=000256796.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000256796

0 1
O -0.310097 -0.974645 -2.105933
O 0.385535 -2.398571 -0.462318
N 1.235668 -0.221453 -0.592594
C -4.349478 -1.508739 0.088623
C -3.952735 -0.815686 1.404991
C -3.149250 -2.079356 -0.625933
C -3.140801 0.425022 1.191653
C -2.627480 -1.445093 -1.691030
C -2.609712 -3.360616 -0.083236
C -1.424760 -1.884634 -2.445991
C -2.990592 1.400937 2.100581
C 2.258384 -0.408755 0.418513
C 1.080947 1.100705 -1.172105
C 0.425801 -1.305459 -0.992500
C -3.643188 1.373203 3.449033
C -2.138503 2.601264 1.818261
C 3.467532 0.302068 0.298458
C 0.986380 2.207117 -0.308335
C 2.045315 -1.279387 1.500386
C 1.030597 1.269503 -2.564891
C 4.452218 0.142154 1.274187
C 0.844190 3.484224 -0.852661
C 3.046857 -1.429769 2.461607
C 0.881511 2.555435 -3.089427
C 4.247086 -0.720173 2.356460
C 0.791869 3.662320 -2.239602
H -5.080352 -2.314926 0.300401
H -4.889022 -0.785604 -0.557037
H -3.373778 -1.519366 2.041518
H -4.876693 -0.583641 1.974569
H -2.636815 0.483688 0.225508
H -3.052786 -0.504774 -2.044125
H -3.013575 -3.614561 0.903659
H -1.507460 -3.316026 0.030182
H -2.825762 -4.203814 -0.752312
H -1.501817 -1.697078 -3.533554
H -1.107322 -2.924833 -2.253299
H -4.734763 1.284293 3.361309
H -3.290894 0.515720 4.038841
H -3.439944 2.275618 4.037480
H -1.350093 2.712784 2.574136
H -1.641857 2.547107 0.839219
H -2.738985 3.520506 1.826818
H 3.638791 0.967447 -0.546645
H 1.023209 2.066882 0.771688
H 1.115456 -1.848803 1.579718
H 1.085380 0.403245 -3.226865
H 5.389370 0.690967 1.186380
H 0.770746 4.346519 -0.190838
H 2.886721 -2.107729 3.299751
H 0.836629 2.693112 -4.169404
H 5.020727 -0.841498 3.111105
H 0.678994 4.661049 -2.656099


%chk=000256796-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000256796

0 1
O -0.488588 -0.626089 -2.144929
O 0.070398 -2.132295 -0.442737
N 1.219834 -0.066770 -0.718394
C -4.535026 -1.338909 0.303574
C -4.105074 -1.209630 1.806258
C -3.438233 -1.897602 -0.594526
C -2.875324 -0.347303 2.006732
C -2.836711 -1.086329 -1.514471
C -3.070885 -3.359037 -0.389144
C -1.712932 -1.467469 -2.436368
C -2.785632 0.856994 2.642907
C 2.176455 -0.203164 0.358585
C 1.249878 1.156143 -1.517093
C 0.258434 -1.036833 -1.036433
C -3.949252 1.584761 3.294777
C -1.450550 1.580420 2.747184
C 3.153257 0.817753 0.535159
C 0.500937 2.278680 -1.101210
C 2.173051 -1.310854 1.253259
C 2.048933 1.216024 -2.679319
C 4.098695 0.730634 1.577802
C 0.544577 3.467997 -1.862399
C 3.127551 -1.379903 2.290433
C 2.090101 2.406944 -3.438172
C 4.096551 -0.367453 2.466382
C 1.338407 3.534459 -3.031600
H -5.425220 -2.001471 0.261338
H -4.845399 -0.341339 -0.059232
H -3.902330 -2.225045 2.205276
H -4.969724 -0.821973 2.375601
H -1.952150 -0.760510 1.572350
H -3.168163 -0.041418 -1.593805
H -3.314617 -3.685105 0.637566
H -1.994237 -3.535371 -0.550484
H -3.642246 -4.011660 -1.078298
H -1.918213 -1.200595 -3.486145
H -1.433671 -2.530820 -2.360836
H -4.910744 1.058938 3.177245
H -3.766356 1.720715 4.379608
H -4.062610 2.600510 2.865657
H -1.178775 1.765361 3.805743
H -0.631770 1.001986 2.284065
H -1.497567 2.575593 2.258343
H 3.178095 1.679740 -0.136019
H -0.110727 2.211688 -0.195100
H 1.436545 -2.104259 1.128785
H 2.624399 0.335267 -2.982780
H 4.839618 1.530193 1.690695
H -0.039943 4.338505 -1.544942
H 3.106346 -2.241737 2.967314
H 2.705257 2.454102 -4.343435
H 4.832190 -0.431664 3.275145
H 1.370558 4.457101 -3.621611


