%chk=000274518.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000274518

0 1
S 1.693484 -1.844920 0.309294
O 1.572906 -2.577302 -0.926542
O 2.282445 -2.506982 1.460232
N -0.645762 -0.743845 0.010553
N 0.100239 -1.458927 0.914101
C -3.682701 1.064056 0.240805
C -4.202508 -0.402683 0.567641
C -2.784477 0.252640 -0.792576
C -3.997530 -0.730168 -0.953158
C -2.943924 -1.088013 1.179710
C -1.916653 -0.579652 0.156509
C -4.727600 1.962336 -0.411298
C -2.973799 1.840628 1.337422
C 2.444457 -0.325697 0.047558
C 3.387764 0.151369 0.966869
C 2.124189 0.436991 -1.081681
C 4.014155 1.378384 0.757053
C 2.747681 1.666743 -1.297139
C 3.698477 2.145028 -0.379752
C 4.357806 3.465168 -0.600400
H -5.153499 -0.558661 1.054128
H -2.321572 0.734722 -1.641752
H -4.789454 -0.387209 -1.623130
H -3.762918 -1.763918 -1.213115
H -3.026376 -2.184123 1.190390
H -2.730013 -0.760388 2.206220
H -4.257004 2.826782 -0.894203
H -5.316259 1.447880 -1.180001
H -5.436021 2.343852 0.333363
H -2.064886 1.350234 1.704881
H -2.660077 2.830270 0.982578
H -3.633486 1.991362 2.199556
H -0.362375 -2.067827 1.604355
H 3.638148 -0.445559 1.852823
H 1.380960 0.070286 -1.799788
H 4.747525 1.742404 1.473613
H 2.494355 2.254127 -2.177291
H 4.452976 3.715174 -1.666399
H 3.774363 4.273280 -0.131582
H 5.368463 3.508456 -0.170850


%chk=000274518-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000274518

0 1
S 1.670374 -1.819685 0.133963
O 1.445146 -2.465293 -1.342368
O 2.301885 -2.687921 1.357716
N -0.761519 -0.542949 -0.061446
N 0.014891 -1.181723 0.910174
C -3.927942 1.008431 0.289485
C -4.308065 -0.489499 0.695560
C -3.032732 0.230309 -0.797214
C -4.186076 -0.856434 -0.831717
C -2.957286 -1.061895 1.228593
C -2.057035 -0.492340 0.109316
C -5.099167 1.820579 -0.305903
C -3.195261 1.900299 1.311203
C 2.606248 -0.208660 -0.060928
C 3.327853 0.275396 1.041094
C 2.574478 0.426915 -1.311238
C 4.054846 1.473434 0.870371
C 3.309853 1.623921 -1.453718
C 4.050960 2.165986 -0.370287
C 4.810631 3.470186 -0.529639
H -5.212240 -0.711689 1.280649
H -2.630178 0.715893 -1.694685
H -5.048403 -0.561416 -1.444740
H -3.888798 -1.889079 -1.078720
H -2.959341 -2.169839 1.255827
H -2.676669 -0.695633 2.232596
H -4.716629 2.727038 -0.811279
H -5.710225 1.264139 -1.035109
H -5.773428 2.154179 0.506044
H -2.279359 1.440681 1.718542
H -2.895397 2.853008 0.835523
H -3.863503 2.147530 2.158084
H -0.394591 -2.027266 1.373442
H 3.335213 -0.276326 1.986450
H 2.008971 -0.009573 -2.140014
H 4.634301 1.873151 1.710470
H 3.307188 2.142785 -2.419127
H 5.149579 3.618226 -1.569545
H 4.167471 4.332611 -0.267477
H 5.695455 3.508822 0.129047


