%chk=000218422.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000218422

0 1
O 0.119740 1.699653 1.253962
N 1.384876 -0.151875 0.887133
N -3.482570 -0.594354 1.053903
C -1.100572 -0.234244 0.478947
C -1.495346 0.153069 -0.958199
C -2.233818 0.114702 1.468017
C 0.158766 0.536939 0.872836
C 2.634256 0.642570 1.069272
C 1.601485 -1.433710 0.167336
C -2.815342 -0.528560 -1.337577
C 3.339324 0.895943 -0.273774
C 2.276359 -1.208103 -1.196940
C 3.580438 -0.414201 -1.035434
C -3.920631 -0.196297 -0.320565
H -0.930298 -1.341606 0.523216
H -0.697358 -0.133877 -1.667044
H -1.597677 1.254779 -1.034931
H -1.966634 -0.238798 2.487773
H -2.344625 1.221614 1.526354
H 3.296393 0.081479 1.763084
H 2.379113 1.610696 1.563541
H 0.634225 -1.972763 0.045536
H 2.244697 -2.076795 0.811212
H -3.131083 -0.216011 -2.349459
H -2.673523 -1.627226 -1.377015
H 4.297349 1.418824 -0.096935
H 2.726471 1.583790 -0.889483
H 1.588785 -0.665188 -1.873791
H 2.478078 -2.181999 -1.679730
H 4.015538 -0.197881 -2.029199
H 4.330387 -1.027859 -0.499926
H -4.187703 0.880086 -0.395531
H -4.837444 -0.779326 -0.556750
H -4.229255 -0.371569 1.722861


%chk=000218422-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000218422

0 1
O 0.074900 1.648173 1.555552
N 1.358565 -0.064059 0.649568
N -3.549414 -0.527707 1.090311
C -1.155141 -0.233061 0.581945
C -1.529903 0.052161 -0.905168
C -2.326624 0.202173 1.496402
C 0.129727 0.514122 0.972237
C 2.608827 0.652122 0.996101
C 1.571816 -1.352672 -0.040930
C -2.872597 -0.620577 -1.277086
C 3.474005 0.893287 -0.261981
C 2.416499 -1.161470 -1.325723
C 3.745392 -0.434406 -1.009741
C -3.981866 -0.205208 -0.286494
H -1.038548 -1.326204 0.711936
H -0.726937 -0.291735 -1.585528
H -1.614094 1.150146 -1.035661
H -2.093037 -0.043638 2.547734
H -2.427519 1.310024 1.429780
H 3.177836 0.041072 1.729392
H 2.318196 1.597768 1.480881
H 0.606140 -1.819033 -0.284378
H 2.111835 -2.040465 0.646018
H -3.165748 -0.341756 -2.307706
H -2.762036 -1.721788 -1.240839
H 4.425860 1.372405 0.037236
H 2.944755 1.599486 -0.931097
H 1.832270 -0.566763 -2.055801
H 2.611391 -2.150968 -1.782724
H 4.312498 -0.247550 -1.940990
H 4.377629 -1.089589 -0.374418
H -4.189340 0.887784 -0.425122
H -4.915624 -0.754595 -0.507365
H -4.307311 -0.425576 1.776357


