%chk=000240939.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000240939

0 1
O 0.272763 2.340248 -0.186679
O -3.366741 0.690021 -2.744414
O -3.090063 2.326042 -1.357612
N -1.093113 0.428933 0.214527
N -3.267969 1.148649 -1.624566
C 0.048733 -0.425931 0.678817
C 1.356262 0.219128 0.306507
C 2.586820 -0.516762 0.355445
C 1.388568 1.531806 -0.126610
C -0.890670 1.866407 0.533941
C -2.404105 -0.107371 0.413732
C 3.787024 0.119065 -0.066840
C 2.583433 2.179545 -0.570275
C 3.753909 1.473889 -0.539884
C 2.655573 -1.869838 0.816546
C -3.445159 0.209930 -0.487725
C 5.018828 -0.603151 -0.019935
C -2.677355 -1.044638 1.437323
C 3.854724 -2.539551 0.850942
C 5.053975 -1.900881 0.428553
C -4.708502 -0.395529 -0.372986
C -3.932688 -1.633195 1.549024
C -4.955419 -1.309701 0.645865
H -0.047503 -1.407462 0.152120
H 0.023554 -0.618780 1.776313
H -1.701751 2.511674 0.118438
H -0.707947 2.054925 1.611652
H 2.518608 3.207725 -0.922742
H 4.686220 1.931339 -0.874082
H 1.744641 -2.367937 1.139957
H -1.899768 -1.304662 2.155535
H 5.930026 -0.103231 -0.347871
H 3.905973 -3.570048 1.201209
H 5.988945 -2.456145 0.466213
H -5.493560 -0.149941 -1.094392
H -4.125165 -2.351361 2.348875
H -5.935499 -1.776212 0.737677


%chk=000240939-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000240939

0 1
O 0.215186 2.285663 -0.457457
O -4.607506 2.035787 -1.683597
O -2.354131 1.777879 -1.881152
N -1.106789 0.417642 0.359026
N -3.491774 1.466999 -1.346114
C 0.061463 -0.396220 0.763393
C 1.365018 0.247175 0.301369
C 2.609429 -0.466544 0.447524
C 1.374329 1.499315 -0.330332
C -0.849431 1.853266 0.454758
C -2.383766 -0.160329 0.322618
C 3.828116 0.108751 -0.087300
C 2.567428 2.063436 -0.880791
C 3.768676 1.376151 -0.760997
C 2.692883 -1.742154 1.101513
C -3.542384 0.369290 -0.357093
C 5.063607 -0.600160 0.055549
C -2.597340 -1.382076 1.045516
C 3.914668 -2.410780 1.227408
C 5.113317 -1.838328 0.701624
C -4.820172 -0.234274 -0.216281
C -3.855525 -1.993352 1.140974
C -4.991357 -1.408262 0.528334
H -0.030780 -1.388603 0.283792
H 0.081301 -0.563924 1.866504
H -1.727377 2.453014 0.201895
H -0.505079 2.083882 1.488040
H 2.496871 3.034953 -1.378106
H 4.689697 1.800999 -1.175934
H 1.789887 -2.204098 1.515568
H -1.759470 -1.834904 1.580535
H 5.976805 -0.152429 -0.354623
H 3.956333 -3.382084 1.732821
H 6.063749 -2.372375 0.805414
H -5.655431 0.233751 -0.743652
H -3.956202 -2.919542 1.717348
H -5.978646 -1.870515 0.614505


