%mem=48GB
%nprocshared=24
#p opt freq=noraman b3lyp/cc-pVTZ empiricaldispersion=gd3bj nosymm SCRF=(PCM,Read)

Second ts NitroFurantoin second trial

0 1
C         -7.72900       -0.21900       -0.42100
C         -9.20700        0.28400        1.29900
C         -7.92400        1.05800        1.54800
H         -8.11200        2.13100        1.52200
H         -7.49600        0.79700        2.51500
N         -8.99000       -0.41900        0.13100
H         -9.67100       -1.02000       -0.30500
O        -10.20600        0.27700        1.96800
O         -7.32900       -0.70000       -1.46000
N         -7.06900        0.63200        0.44700
N         -5.86700        1.24300        0.28300
H         -5.85600        2.99000        0.89100
H         -4.84500       -2.17000       -3.07700
H         -5.90800       -1.10300       -2.82900
Cl        -6.13400        4.23300        1.23600
O         -3.37600        2.47700        0.01300
C         -2.16700        2.86100       -0.44100
C         -1.74900        2.10200       -1.49500
H         -0.82400        2.21400       -2.02900
C         -3.75700        1.43200       -0.77400
C         -2.78800        1.16600       -1.71200
H         -2.85100        0.39900       -2.46400
C         -5.01800        0.78800       -0.56800
H         -5.18800       -0.08300       -1.18300
O         -4.99800       -1.22200       -3.13400
N         -1.52900        3.94700        0.22900
O         -2.10100        4.45200        1.18400
O         -0.43600        4.28800       -0.21500

Eps=2.350


