%chk=000201301.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000201301

0 1
O -0.132506 0.611571 -0.694349
O -1.651698 2.279998 -2.362784
N -3.488570 0.973667 0.554978
C -1.946165 2.093684 -0.974450
C 0.553615 -1.830532 -1.729734
C -2.935811 0.914819 -0.826213
C 1.425830 -1.131366 -0.708961
C -0.648479 1.877288 -0.179640
C -3.563052 -0.369335 1.228165
C 1.053844 0.130590 -0.179249
C 2.615388 -1.692441 -0.245046
C -0.013796 -3.132750 -1.148078
C 1.332096 -2.092111 -3.025877
C 1.829037 0.799964 0.769333
C 3.023379 0.204565 1.213819
C -4.576480 -0.290328 2.378604
C -2.167581 -0.738902 1.746305
C 3.411826 -1.039454 0.704830
C 3.862979 0.914069 2.226440
H -2.416898 3.063257 -0.686640
H -0.311782 -1.159256 -1.979288
H -2.395184 -0.039900 -1.015911
H -3.712573 0.997102 -1.615011
H -3.900522 -1.164811 0.510536
H -0.851458 1.769163 0.901623
H 0.092897 2.668346 -0.378344
H -4.408630 1.422817 0.541750
H 2.933905 -2.662460 -0.629376
H 0.776896 -3.852759 -0.912616
H -0.698636 -3.615640 -1.852208
H -0.565727 -2.940412 -0.220874
H 1.769856 -1.165499 -3.414739
H 0.680517 -2.505544 -3.802296
H 2.152749 -2.801083 -2.875313
H 1.531761 1.763756 1.165913
H -4.578628 -1.218303 2.961162
H -4.331286 0.524463 3.072203
H -5.597095 -0.125604 2.020208
H -1.422945 -0.732507 0.936366
H -2.160404 -1.732190 2.202729
H -1.818724 -0.020163 2.497226
H 4.332532 -1.506219 1.042428
H -1.071027 1.555835 -2.689488
H 4.753206 0.341463 2.516966
H 4.213785 1.882684 1.841810
H 3.294661 1.115771 3.145592


%chk=000201301-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000201301

0 1
O -0.034884 0.486474 -0.766113
O -1.758789 1.919363 -2.381069
N -3.426114 0.921429 0.856231
C -1.980290 1.877184 -0.928731
C 1.034949 -1.745036 -2.090451
C -3.016243 0.787776 -0.559994
C 1.821358 -1.021251 -0.993853
C -0.651707 1.695879 -0.183114
C -4.098815 -0.260928 1.468119
C 1.247708 0.101043 -0.321779
C 3.103862 -1.429432 -0.567370
C -0.041492 -2.673746 -1.457794
C 1.924597 -2.539146 -3.073412
C 1.928271 0.769250 0.719410
C 3.215564 0.339003 1.133606
C -4.828666 0.196649 2.747732
C -3.068982 -1.366089 1.790089
C 3.795166 -0.769467 0.477012
C 3.943836 1.068888 2.250224
H -2.390071 2.873159 -0.674646
H 0.494270 -0.971250 -2.672040
H -2.552033 -0.203966 -0.705319
H -3.861337 0.866024 -1.281909
H -4.861188 -0.689280 0.769563
H -0.848919 1.550157 0.895897
H 0.015018 2.563936 -0.351237
H -3.995484 1.769532 0.992576
H 3.582377 -2.281051 -1.062242
H 0.439156 -3.475017 -0.865905
H -0.659052 -3.147587 -2.244071
H -0.707886 -2.103305 -0.787408
H 2.711596 -1.901544 -3.515585
H 1.307488 -2.945212 -3.895775
H 2.415317 -3.398028 -2.578137
H 1.468695 1.625193 1.224573
H -5.311194 -0.660124 3.250135
H -4.109252 0.654288 3.451714
H -5.614925 0.942254 2.519500
H -2.511433 -1.684201 0.890642
H -3.574949 -2.258240 2.203472
H -2.336915 -0.995208 2.530036
H 4.789643 -1.118749 0.777555
H -1.129249 1.180431 -2.593241
H 4.881608 0.553771 2.520392
H 4.203140 2.103232 1.953268
H 3.321351 1.138244 3.161948


