%chk=000253447.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000253447

0 1
O -0.187247 0.933881 -0.237667
O -4.453182 -0.996808 0.026765
O 1.201501 -1.886821 2.368603
N -2.343677 0.036755 -0.165608
N -2.729194 -2.037812 1.100803
C 1.992061 -0.582425 0.564576
C -0.485956 -1.094701 0.955252
C 0.924441 -1.234713 1.379166
C 4.065260 0.603574 -0.908219
C -1.014836 -0.036910 0.175210
C 2.001749 -0.672474 -0.833616
C 3.030407 0.091265 1.226324
C 3.033656 -0.084358 -1.567349
C 4.056063 0.688863 0.494675
C -1.416783 -2.062678 1.409083
C 5.177414 1.229157 -1.684584
C -3.144649 -0.975314 0.310862
C -0.739101 2.048424 -1.050378
C -4.992355 0.108918 -0.808634
C 0.495156 2.883448 -1.304692
C -6.456459 -0.254383 -0.900179
H 1.201116 -1.202987 -1.349824
H 3.031417 0.139131 2.317562
H 3.039712 -0.167696 -2.651580
H 4.855866 1.213293 1.013230
H -1.073784 -2.894872 2.050701
H 6.097882 0.631589 -1.593939
H 4.955161 1.313767 -2.756057
H 5.413544 2.239260 -1.322236
H -1.179638 1.612069 -1.962032
H -1.511916 2.554305 -0.449116
H -4.799011 1.057260 -0.279710
H -4.464817 0.088952 -1.776821
H 0.334046 3.601615 -2.116677
H 0.805894 3.441197 -0.410893
H 1.352553 2.245442 -1.580919
H -7.012678 0.480094 -1.495031
H -6.599853 -1.243193 -1.360736
H -6.922360 -0.307513 0.095286


%chk=000253447-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000253447

0 1
O -0.396513 1.288800 -0.102336
O -4.403487 -1.185450 -0.070438
O 1.182219 -1.193563 2.716741
N -2.407619 0.065153 -0.124452
N -2.600924 -2.045744 1.079940
C 2.095434 -0.415673 0.630002
C -0.447965 -0.852269 1.009277
C 0.962700 -0.817375 1.519500
C 4.358864 0.256632 -0.985420
C -1.100961 0.159475 0.239783
C 2.011678 -0.462721 -0.785163
C 3.326925 -0.036409 1.229979
C 3.130796 -0.137123 -1.578266
C 4.434593 0.304317 0.434289
C -1.291927 -1.917466 1.424796
C 5.568041 0.596378 -1.837209
C -3.089279 -1.038535 0.296602
C -1.108901 2.359407 -0.864873
C -5.016187 -0.111411 -0.906343
C -0.086793 3.468689 -1.089620
C -6.461356 -0.535059 -1.146122
H 1.076757 -0.770594 -1.265407
H 3.387127 -0.019544 2.323344
H 3.055367 -0.190354 -2.670972
H 5.374398 0.607493 0.911739
H -0.877095 -2.701470 2.066294
H 6.316563 -0.218991 -1.804205
H 5.291611 0.750736 -2.894302
H 6.071468 1.511562 -1.476104
H -1.483862 1.926786 -1.810100
H -1.977312 2.693542 -0.269248
H -4.939195 0.846656 -0.360431
H -4.439319 -0.021236 -1.844967
H -0.550865 4.293243 -1.661109
H 0.275421 3.870666 -0.128310
H 0.781855 3.093718 -1.657154
H -6.976193 0.223750 -1.763338
H -6.504439 -1.502994 -1.673584
H -7.004221 -0.636421 -0.191213


