%chk=000292215.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000292215

0 1
S 2.139866 -0.253910 1.197996
S 3.135746 -1.877738 -1.017196
O 1.014739 0.739078 -1.060804
O 1.049781 3.608723 0.147324
N -3.629959 -1.600767 -0.604540
C -0.842140 -0.793344 -0.728392
C -1.324793 -1.999865 0.100718
C 0.676784 -0.715089 -1.098352
C -2.755896 -1.649398 0.608509
C 1.613713 -1.413804 -0.108056
C -0.977700 0.467978 0.087499
C -1.725542 -0.722427 -1.995020
C -0.329531 -2.361158 1.204720
C 1.042116 -2.645767 0.571767
C -2.843473 -0.366067 1.488359
C -1.918785 0.737718 1.068369
C -3.211601 -0.582648 -1.620519
C 0.083008 1.339798 -0.209319
C -1.870917 2.013666 1.665529
C 0.117236 2.614474 0.363406
C 3.619684 0.414819 0.371289
C 4.351949 -0.738204 -0.264134
C -0.892208 2.939912 1.298127
C 1.944514 3.395349 -0.973294
H -1.428508 -2.889329 -0.575411
H 0.881570 -0.979162 -2.155492
H -3.131690 -2.506893 1.226490
H -1.574921 -1.633793 -2.604600
H -1.425458 0.135191 -2.626735
H -0.676676 -3.249619 1.764076
H -0.256292 -1.544569 1.951149
H 1.742614 -3.024273 1.348080
H 0.947902 -3.479280 -0.158119
H -2.600846 -0.638618 2.537855
H -3.889570 -0.003844 1.514090
H -3.404184 0.458934 -1.278166
H -3.839157 -0.755029 -2.522999
H -4.599753 -1.411452 -0.326528
H -2.598487 2.282713 2.427284
H 4.225783 0.933522 1.139259
H 3.297737 1.184047 -0.374365
H 5.037374 -0.408690 -1.069853
H 4.956394 -1.305471 0.471914
H -0.869746 3.931044 1.750352
H 2.569500 4.293671 -0.944611
H 1.372072 3.328821 -1.903200
H 2.538352 2.478552 -0.818358


%chk=000292215-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000292215

0 1
S 2.214053 -0.404521 1.426110
S 3.274888 -1.926295 -1.036896
O 1.009741 0.749097 -1.117831
O 1.115388 3.626956 0.069665
N -3.611376 -1.516471 -0.635795
C -0.818478 -0.794506 -0.694099
C -1.338304 -2.011342 0.111972
C 0.700496 -0.737480 -1.056001
C -2.776155 -1.640461 0.592835
C 1.665018 -1.465700 -0.061461
C -0.944826 0.472005 0.130811
C -1.697716 -0.671490 -1.982404
C -0.337457 -2.464011 1.189237
C 1.022631 -2.755096 0.504511
C -2.817998 -0.394479 1.549143
C -1.888415 0.737970 1.127070
C -3.184474 -0.480247 -1.612027
C 0.076723 1.361224 -0.228964
C -1.823436 2.026285 1.726448
C 0.128810 2.656794 0.323886
C 3.748006 0.288108 0.580720
C 4.502704 -0.892062 -0.035026
C -0.853355 2.965702 1.306765
C 1.623454 3.703896 -1.313790
H -1.479999 -2.859478 -0.588913
H 0.895511 -1.111252 -2.075409
H -3.183426 -2.502757 1.157768
H -1.579056 -1.597521 -2.578732
H -1.358824 0.182566 -2.598549
H -0.705933 -3.383436 1.683633
H -0.206736 -1.698851 1.979413
H 1.741328 -3.218631 1.201276
H 0.859838 -3.472783 -0.325552
H -2.538656 -0.722303 2.572888
H -3.867844 -0.044326 1.621318
H -3.327383 0.560358 -1.237806
H -3.806229 -0.589455 -2.520461
H -4.612198 -1.440208 -0.410590
H -2.526799 2.302671 2.520734
H 4.337106 0.790442 1.367780
H 3.426010 1.015249 -0.179427
H 5.276614 -0.553357 -0.746288
H 4.953082 -1.530548 0.741134
H -0.807838 3.962365 1.758273
H 2.388022 4.495412 -1.295271
H 0.808578 3.984341 -2.009118
H 2.065510 2.745427 -1.636883


