%chk=000241550.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000241550

0 1
O 1.599612 0.204518 0.644970
O -0.597273 -2.800181 0.372494
O 0.840472 4.681342 -1.247520
O 3.591612 -2.141317 1.306818
O -2.363195 1.303031 -1.226026
N -1.775768 -0.460410 0.084401
N 0.156942 1.835918 -0.038059
N 1.406256 -2.240823 -0.617470
C -0.414170 -0.547631 -0.470082
C 0.535034 0.525408 0.122565
C 0.121938 -1.969966 -0.158659
C 1.006006 2.942023 0.459693
C 2.101318 -3.452749 -0.116882
C 1.700948 3.680474 -0.695985
C 2.672679 -3.234816 1.298417
C -2.715362 0.433880 -0.435854
C -4.110164 0.273815 0.080356
H -0.443797 -0.398169 -1.590460
H -2.040152 -1.229921 0.715769
H -0.722150 2.092078 -0.513734
H 2.040695 -1.453821 -0.807123
H 1.770564 2.540442 1.170117
H 0.370129 3.657689 1.032247
H 2.921581 -3.689358 -0.832196
H 1.395498 -4.316182 -0.115791
H 2.044264 2.996805 -1.491824
H 2.560298 4.275892 -0.326433
H 3.293608 -4.095929 1.611997
H 1.872877 -3.063652 2.041101
H -4.173642 0.384448 1.172777
H -4.767945 1.044101 -0.359407
H -4.545046 -0.702939 -0.179362
H 0.102449 4.271125 -1.742710
H 3.101186 -1.279026 1.302154


%chk=000241550-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000241550

0 1
O 1.623419 0.273058 0.725516
O -0.641542 -2.741678 0.571154
O 1.236258 4.169545 -1.694769
O 3.562356 -1.797520 1.035664
O -2.441030 1.487427 -1.012693
N -1.816167 -0.471019 0.060595
N 0.090958 1.850884 -0.031065
N 1.299455 -2.266455 -0.634690
C -0.441745 -0.519301 -0.454089
C 0.522660 0.569660 0.150292
C 0.071480 -1.950732 -0.128752
C 0.851351 3.005742 0.487574
C 2.080816 -3.415040 -0.129066
C 1.876780 3.542286 -0.532111
C 2.784367 -3.022403 1.197080
C -2.752676 0.457950 -0.310064
C -4.176640 0.214634 0.156866
H -0.459084 -0.356980 -1.552066
H -2.055955 -1.317095 0.604550
H -0.835603 1.976291 -0.501500
H 1.850241 -1.511865 -1.052627
H 1.379352 2.694737 1.407001
H 0.131547 3.806092 0.733138
H 2.831930 -3.676077 -0.894086
H 1.402021 -4.271015 0.024021
H 2.565591 2.727589 -0.835596
H 2.466721 4.349606 -0.068096
H 3.499550 -3.812974 1.482297
H 2.025329 -2.922721 1.999840
H -4.279858 -0.689222 0.779401
H -4.528702 1.091076 0.726767
H -4.831251 0.117041 -0.726659
H 0.704024 3.487608 -2.178275
H 2.941348 -1.013031 1.044748


