%chk=000188250.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000188250

0 1
O 1.912448 -2.276417 1.044779
O -4.272889 1.962813 0.696559
N -0.204931 -0.367917 0.976470
C 1.052810 -0.148992 0.170342
C 2.263911 -0.872571 0.869359
C -0.477812 -1.839184 1.101930
C -1.385072 0.310411 0.340001
C 0.711844 -2.506719 1.799472
C 1.344669 1.329999 0.006078
C 3.444805 -0.941800 -0.094416
C 2.646183 -0.289506 2.225276
C -2.533106 0.438383 1.370277
C 1.153476 2.241180 1.055789
C 1.826248 1.793274 -1.228832
C 3.653721 -2.094153 -0.866096
C 4.323411 0.143337 -0.225182
C -2.206010 1.453659 2.462159
C -3.806781 0.847456 0.622636
C 1.442606 3.595720 0.873343
C 2.116425 3.148573 -1.406603
C 4.730940 -2.161956 -1.753679
C 5.397521 0.074642 -1.116525
C -4.451569 -0.194620 -0.243641
C 1.925545 4.052499 -0.357016
C 5.604283 -1.077611 -1.881446
C -4.376998 -1.562224 0.052754
C -5.167240 0.234669 -1.372066
C -5.002015 -2.493958 -0.779891
C -5.785523 -0.698975 -2.207802
C -5.702398 -2.063332 -1.912363
H 0.951005 -0.619397 -0.847595
H -1.396456 -1.967958 1.716215
H -0.665521 -2.330509 0.122148
H -1.742919 -0.220000 -0.569920
H -1.088800 1.332801 0.010033
H 0.639647 -3.609146 1.793803
H 0.847152 -2.140872 2.832487
H 3.123019 0.693150 2.133805
H 1.763992 -0.163029 2.866749
H 3.348657 -0.955937 2.741842
H -2.705093 -0.558083 1.855020
H 0.763970 1.886269 2.011842
H 1.987252 1.095980 -2.050337
H 2.975205 -2.944211 -0.758603
H 4.167163 1.048478 0.362893
H -2.975577 1.469285 3.241641
H -1.242366 1.218364 2.932648
H -2.142768 2.473045 2.056383
H 1.288447 4.297403 1.691342
H 2.491572 3.500039 -2.366265
H 4.889746 -3.061977 -2.344397
H 6.074590 0.921158 -1.213317
H 2.149522 5.107807 -0.497768
H 6.442772 -1.130379 -2.572632
H -3.839210 -1.902898 0.937910
H -5.241918 1.304704 -1.583911
H -4.946637 -3.555810 -0.546240
H -6.336489 -0.362404 -3.084910
H -6.186659 -2.791854 -2.562032


%chk=000188250-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000188250

0 1
O 2.099426 -2.316644 1.258430
O -3.985592 2.071525 0.519596
N -0.126442 -0.475404 1.006184
C 1.142829 -0.250120 0.231209
C 2.386627 -0.867800 1.016811
C -0.334886 -1.928133 1.243961
C -1.322347 0.114678 0.343684
C 0.849902 -2.541836 1.991181
C 1.364172 1.222705 -0.109059
C 3.613640 -0.882853 0.090446
C 2.654620 -0.174290 2.366708
C -2.536985 0.279436 1.319916
C 1.136514 2.253606 0.840213
C 1.829543 1.580968 -1.398405
C 3.775836 -1.945570 -0.836955
C 4.575372 0.157444 0.098823
C -2.186186 1.199104 2.504786
C -3.724938 0.831683 0.509397
C 1.374019 3.604601 0.508523
C 2.071668 2.932195 -1.733358
C 4.871669 -1.967426 -1.727430
C 5.673016 0.137254 -0.790561
C -4.560445 -0.106453 -0.325240
C 1.845354 3.950783 -0.779870
C 5.826845 -0.924632 -1.709671
C -4.336623 -1.509626 -0.379419
C -5.621466 0.449120 -1.092545
C -5.156106 -2.334819 -1.179458
C -6.439766 -0.373682 -1.889947
C -6.209490 -1.770478 -1.935710
H 1.102542 -0.825620 -0.728547
H -1.248899 -2.070271 1.849959
H -0.477780 -2.470257 0.272925
H -1.628417 -0.500945 -0.538405
H -1.058980 1.115869 -0.034270
H 0.750026 -3.638954 2.051688
H 0.913102 -2.131109 3.018547
H 3.013309 0.857900 2.232245
H 1.734932 -0.118218 2.972502
H 3.423739 -0.742915 2.917018
H -2.819949 -0.718045 1.709859
H 0.751325 1.991183 1.831025
H 2.011474 0.795291 -2.141335
H 3.054134 -2.767089 -0.827240
H 4.474359 0.998923 0.790828
H -3.009946 1.230627 3.239907
H -1.272564 0.828713 3.000081
H -2.014817 2.230161 2.151585
H 1.183810 4.387630 1.251342
H 2.432545 3.187792 -2.735914
H 4.983261 -2.800918 -2.430631
H 6.403939 0.953432 -0.765895
H 2.025724 5.000150 -1.038996
H 6.679059 -0.941598 -2.398649
H -3.529270 -1.966571 0.202178
H -5.777995 1.531722 -1.040199
H -4.976299 -3.414954 -1.213301
H -7.254658 0.066322 -2.475122
H -6.845681 -2.412889 -2.554922


