%chk=000237780.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000237780

0 1
O -3.449405 2.306679 1.107371
O 3.449351 -2.305930 1.109327
O -5.598992 -1.607322 -0.949914
O 5.599017 1.607295 -0.949280
N -4.977227 0.377140 0.042016
N 4.977202 -0.377258 0.042431
C -0.738205 0.047267 0.004282
C 0.738182 -0.047407 0.004344
C -1.363561 1.171859 0.573364
C 1.363522 -1.171525 0.574378
C -1.515954 -0.972069 -0.556540
C 1.515945 0.971465 -0.557302
C -3.561592 0.213270 0.001334
C 3.561568 -0.213397 0.001638
C -2.752994 1.241582 0.567468
C 2.752957 -1.241240 0.568602
C -2.912993 -0.892666 -0.561179
C 2.912984 0.892061 -0.561832
C -5.921608 -0.551531 -0.440849
C 5.921614 0.551544 -0.440120
C -7.347327 -0.107796 -0.263869
C 7.347334 0.107956 -0.262776
H -0.765403 1.964957 1.014658
H 0.765353 -1.964263 1.016303
H -1.032571 -1.839047 -1.007273
H 1.032573 1.838065 -1.008770
H -3.505213 -1.702303 -1.008984
H 3.505219 1.701347 -1.010250
H -5.298585 1.252596 0.469099
H 5.298538 -1.252634 0.469694
H -2.838601 2.987876 1.480373
H 2.838551 -2.986565 1.483359
H -7.614947 0.040814 0.790633
H -8.028037 -0.880034 -0.661413
H -7.569238 0.821481 -0.805353
H 7.614676 -0.040741 0.791782
H 8.028068 0.880312 -0.660048
H 7.569499 -0.821237 -0.804301


%chk=000237780-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000237780

0 1
O -3.557648 2.456651 0.626162
O 3.557554 -2.456198 0.628276
O -5.773807 -1.812618 -0.560617
O 5.773864 1.812286 -0.561044
N -5.017600 0.332838 0.014224
N 5.017582 -0.332784 0.015138
C -0.743357 0.031001 -0.030204
C 0.743343 -0.030997 -0.030082
C -1.418877 1.239394 0.300792
C 1.418822 -1.239167 0.301804
C -1.537498 -1.101016 -0.356582
C 1.537524 1.100807 -0.357104
C -3.613120 0.154898 -0.024414
C 3.613106 -0.154876 -0.023814
C -2.820340 1.293661 0.299080
C 2.820286 -1.293426 0.300327
C -2.946454 -1.050305 -0.354770
C 2.946479 1.050105 -0.355062
C -6.013763 -0.610245 -0.241388
C 6.013778 0.610129 -0.240972
C -7.432711 -0.058294 -0.101724
C 7.432708 0.058273 -0.100750
H -0.841405 2.124723 0.594844
H 0.841315 -2.124305 0.596365
H -1.049538 -2.034424 -0.656362
H 1.049598 2.034013 -0.657571
H -3.547224 -1.923508 -0.614370
H 3.547281 1.923140 -0.615155
H -5.309268 1.281898 0.269004
H 5.309216 -1.281671 0.270601
H -2.961594 3.214966 0.835883
H 2.961474 -3.214348 0.838515
H -7.616628 0.321975 0.920220
H -8.145954 -0.867629 -0.313231
H -7.612101 0.770029 -0.811964
H 7.616464 -0.321399 0.921444
H 8.145978 0.867489 -0.312617
H 7.612219 -0.770462 -0.810479


