%chk=000189972.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000189972

0 1
N 1.055908 -1.732658 0.000096
C -0.851973 0.389812 -0.000048
C -1.223404 -0.988567 -0.000055
C -2.655141 -1.177901 -0.000125
C -2.126356 1.140557 -0.000143
C 0.498688 0.691878 0.000032
C -3.219899 0.189256 -0.000213
C -0.290900 -2.034795 0.000061
C 1.429557 -0.434649 0.000039
C 2.872988 -0.143555 -0.000078
C -3.139217 -2.453638 -0.000064
C 1.017783 2.044781 0.000217
C -2.381571 2.497354 -0.000146
C -4.528242 0.628505 -0.000316
C 3.314111 1.199952 0.000047
C -0.836611 -3.370645 0.000128
C 2.346573 2.287410 0.000294
C -2.197475 -3.546619 0.000049
C -3.725034 2.932969 -0.000269
C -4.773076 2.020093 -0.000357
C 3.829349 -1.185052 -0.000365
C 4.700353 1.478326 -0.000121
C 5.186108 -0.894855 -0.000561
C 5.623515 0.442962 -0.000434
H -4.202729 -2.675650 -0.000088
H 0.285450 2.855581 0.000348
H -1.567506 3.222093 -0.000019
H -5.359357 -0.073181 -0.000333
H -0.143674 -4.211390 0.000230
H 2.737527 3.305164 0.000563
H -2.612522 -4.556375 0.000055
H -3.933113 4.002308 -0.000296
H -5.803784 2.373795 -0.000457
H 3.485089 -2.224020 -0.000450
H 5.038131 2.513258 -0.000034
H 5.918086 -1.700867 -0.000801
H 6.691164 0.659461 -0.000586


%chk=000189972-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000189972

0 1
N 1.068780 -1.738689 -0.000116
C -0.875515 0.409449 -0.000093
C -1.229895 -0.969405 -0.000104
C -2.647740 -1.161488 -0.000101
C -2.159333 1.163147 -0.000100
C 0.509030 0.716366 -0.000087
C -3.239410 0.197039 -0.000099
C -0.280813 -2.021412 -0.000102
C 1.445366 -0.425841 -0.000116
C 2.891849 -0.149359 -0.000140
C -3.136838 -2.469389 -0.000087
C 1.045363 2.061951 -0.000031
C -2.456867 2.540946 -0.000117
C -4.579430 0.619583 -0.000109
C 3.362195 1.207658 -0.000095
C -0.804272 -3.362915 -0.000087
C 2.404527 2.296483 -0.000027
C -2.191844 -3.562701 -0.000079
C -3.813733 2.958446 -0.000128
C -4.863673 2.010700 -0.000122
C 3.840758 -1.211199 -0.000208
C 4.766459 1.464795 -0.000119
C 5.218960 -0.939706 -0.000234
C 5.687125 0.405827 -0.000190
H -4.209839 -2.692292 -0.000080
H 0.347046 2.903317 0.000017
H -1.669125 3.300034 -0.000126
H -5.399618 -0.106913 -0.000108
H -0.102766 -4.203369 -0.000080
H 2.790460 3.323178 0.000037
H -2.585934 -4.585546 -0.000068
H -4.046302 4.029070 -0.000143
H -5.905368 2.350640 -0.000133
H 3.459752 -2.235831 -0.000235
H 5.117037 2.503929 -0.000081
H 5.938752 -1.765816 -0.000293
H 6.763652 0.610412 -0.000214


