%chk=000256757.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000256757

0 1
O 1.371203 0.844030 1.636550
N -1.000029 0.665592 0.246823
N -2.905004 0.278379 -1.129381
N 4.063844 1.430952 1.236578
C -0.280182 -0.475122 -0.375406
C 1.198763 -0.157259 -0.509059
C -0.523543 -1.756639 0.412460
C 1.962784 0.487396 0.452230
C 1.842418 -0.553783 -1.719746
C 3.362037 0.769122 0.234844
C 3.966151 0.363143 -0.983417
C -2.333183 0.938683 -0.058462
C 3.174251 -0.310707 -1.956844
C -1.462406 -2.674455 -0.083377
C 0.134425 -2.023732 1.619249
C -3.033777 1.922220 0.688856
C -4.337734 2.244607 0.308404
C 5.357575 0.661138 -1.160954
C -1.721086 -3.858138 0.611841
C -0.126316 -3.209596 2.312591
C -4.177321 0.617106 -1.476095
C -1.050131 -4.130043 1.808907
C -4.923429 1.588058 -0.786258
C 6.043064 1.313773 -0.170035
C 5.350523 1.687770 1.031923
C -5.111315 3.268040 1.073866
C -4.761541 -0.110357 -2.645135
H -0.699988 -0.607775 -1.421467
H -0.639230 0.978461 1.151454
H 1.241189 -1.068324 -2.474403
H 3.639949 -0.625861 -2.888772
H -2.005305 -2.451843 -1.004058
H 0.848001 -1.304893 2.025232
H -2.561833 2.416005 1.528511
H 5.845448 0.360314 -2.088448
H -2.449377 -4.566990 0.222932
H 0.391108 -3.413959 3.247781
H -1.250477 -5.053095 2.348423
H -5.934152 1.820979 -1.095215
H 2.012294 1.339672 2.232061
H 7.098919 1.557423 -0.268137
H 5.890586 2.211046 1.831100
H -5.615935 2.803174 1.934512
H -4.468255 4.066468 1.468199
H -5.887808 3.748729 0.464094
H -5.041906 0.589641 -3.444363
H -4.054151 -0.835135 -3.077656
H -5.663519 -0.665815 -2.353633


%chk=000256757-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000256757

0 1
O 1.366264 1.038951 1.637936
N -1.064319 0.527678 0.384152
N -2.910537 0.276593 -1.064354
N 3.896722 1.604793 1.173567
C -0.331946 -0.568251 -0.275262
C 1.143490 -0.216227 -0.467861
C -0.531808 -1.919382 0.447885
C 1.893291 0.539291 0.443532
C 1.822807 -0.686489 -1.642688
C 3.275637 0.843312 0.197422
C 3.932420 0.365577 -0.988843
C -2.335288 0.920562 -0.001051
C 3.168300 -0.417694 -1.911405
C -1.562122 -2.787354 0.005926
C 0.256261 -2.299735 1.563402
C -3.000925 1.978279 0.699593
C -4.280153 2.381489 0.284070
C 5.311224 0.723766 -1.140526
C -1.800355 -4.014201 0.665047
C 0.017107 -3.524531 2.224786
C -4.156515 0.676924 -1.472086
C -1.010450 -4.387676 1.776898
C -4.867607 1.713504 -0.831655
C 5.938370 1.496464 -0.156183
C 5.193809 1.918728 0.991806
C -5.024571 3.496589 0.993808
C -4.731762 -0.074910 -2.655369
H -0.799047 -0.666123 -1.272300
H -0.615042 0.967596 1.191442
H 1.242056 -1.284315 -2.354928
H 3.639431 -0.796811 -2.824708
H -2.185630 -2.478520 -0.841228
H 1.052488 -1.636801 1.919494
H -2.509013 2.465433 1.549464
H 5.863290 0.388585 -2.026005
H -2.599900 -4.676633 0.313634
H 0.632053 -3.807844 3.087004
H -1.192712 -5.339622 2.288771
H -5.864129 1.995883 -1.186537
H 2.135167 1.540146 2.064864
H 6.990112 1.783762 -0.247082
H 5.669279 2.522477 1.772399
H -5.999596 3.140639 1.376171
H -4.447636 3.892822 1.846822
H -5.233458 4.335315 0.303288
H -5.725330 0.311678 -2.937756
H -4.057935 0.005458 -3.527649
H -4.826196 -1.150777 -2.418606


