%chk=000252176.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000252176

0 1
O -2.628557 -1.983716 -0.384125
O -4.332670 0.453493 1.230953
O -4.587764 0.938261 -0.948606
N -0.490264 -1.170630 -0.263637
N 1.717866 -0.254329 -0.123428
N -1.597458 1.439305 0.081078
N 3.849577 0.778890 0.002404
N 1.980100 2.200196 0.174650
C 0.357625 -0.075297 -0.107893
C 0.063359 -2.560878 -0.377987
C -0.234379 1.231559 0.051377
C -1.930336 -1.008012 -0.240627
C -2.378588 0.399366 -0.057403
C 0.351854 -3.146618 0.997908
C 2.490162 0.885445 0.014360
C 0.659745 2.344867 0.189742
C 4.535035 -0.533724 -0.161206
C -3.856232 0.636235 -0.042505
C 6.042913 -0.342255 -0.108460
H -0.691156 -3.181457 -0.920658
H 0.987737 -2.527492 -0.999320
H 1.100489 -2.555789 1.542358
H -0.551971 -3.191968 1.620447
H 0.738087 -4.169661 0.911656
H 0.250364 3.361604 0.313045
H 4.417207 1.620995 0.104807
H 4.187386 -1.229366 0.640849
H 4.219193 -0.991330 -1.130100
H 6.411398 0.312018 -0.909669
H 6.379221 0.079165 0.848149
H 6.556746 -1.307115 -0.227077
H -5.320090 0.584238 1.289720


%chk=000252176-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000252176

0 1
O -2.648405 -1.979422 -0.319928
O -4.417331 0.020745 1.136880
O -4.493947 1.372819 -0.756097
N -0.461569 -1.127738 -0.198872
N 1.736740 -0.228030 -0.116248
N -1.566603 1.486674 0.062962
N 3.865651 0.759607 -0.048038
N 2.051134 2.217925 0.083219
C 0.390407 -0.031920 -0.096527
C 0.082055 -2.509517 -0.325892
C -0.198241 1.277023 0.019410
C -1.890472 -0.978121 -0.176435
C -2.359103 0.421977 -0.009616
C 0.204485 -3.198096 1.047793
C 2.509068 0.902079 -0.027988
C 0.713738 2.370511 0.105451
C 4.559957 -0.533611 -0.165364
C -3.845700 0.665670 0.041595
C 6.082842 -0.329082 -0.133455
H -0.618300 -3.065254 -0.970627
H 1.065937 -2.427020 -0.812391
H 0.895912 -2.645082 1.706747
H -0.781110 -3.271705 1.537595
H 0.597924 -4.221833 0.914288
H 0.315185 3.386727 0.193117
H 4.402505 1.627010 0.016721
H 4.234358 -1.195806 0.659323
H 4.250113 -1.029259 -1.105491
H 6.421480 0.306865 -0.971953
H 6.406628 0.137884 0.814717
H 6.595423 -1.302014 -0.221433
H -5.404165 0.155992 1.127340


