%nprocshared=12 %mem=18GB #p freq=noraman gen scrf=(solvent=acetonitrile) nosymm cphf=(maxinv=12000,conver=8) m06 pseudo=read opt=modredundant Reactant 1 1 N -1.56328400 -1.88950700 0.24021300 C -0.66351000 -2.87832400 0.27026000 C -2.89938600 -2.16926000 0.17799300 C -1.04928700 -4.21143200 0.23503400 C -3.33665200 -3.48527300 0.14301100 C -2.40338700 -4.51669700 0.17150400 H -0.29159300 -4.98905900 0.26087700 H -4.39937500 -3.70623000 0.09415700 H -2.73629600 -5.55119300 0.14509100 N -3.14372000 0.18148200 0.18710600 C -3.79308800 -1.00256900 0.15859100 C -3.75981800 1.37379400 0.17866200 C -5.18024400 -1.01167800 0.12182800 C -5.15292600 1.40982600 0.14775200 C -5.85358300 0.20983400 0.11878800 H -5.73665800 -1.94454800 0.09872700 H -5.68768700 2.35529200 0.14331700 H -6.93998000 0.22325800 0.09223400 N -1.49339300 2.21405400 0.20966800 C -0.59569800 3.22729300 0.16685200 C -2.84115200 2.51801300 0.18253400 C -1.03889000 4.57743100 0.12634100 C -3.30532900 3.81111900 0.13411700 C -2.37587700 4.86332000 0.11030700 H -0.28863900 5.36464500 0.10737500 H -4.37138500 4.01434500 0.10972700 H -2.71789900 5.89498400 0.07924100 C 0.40128800 0.04767900 -1.56062600 H 1.30850700 0.63389400 -1.43273800 H 0.55763800 -0.99956400 -1.81309600 H -0.38439700 0.54223900 -2.13883500 Pt -1.16720200 0.11701900 0.26429600 O 1.39811387 -0.32131224 1.71364459 O 0.81100300 -0.33070000 0.49822600 H 0.37835500 -2.56627500 0.32739200 H 0.46029061 3.00399186 0.12910744 B 32 28 F B 34 28 F B 32 34 F -Pt 0 lanl2dz F 1 1.0 0.9930000 1.0000000 **** C H N O 6-31+g(d) ****** -Pt 0 lanl2dz