%mem=1gb
%nproc=10
%chk=temp.chk
#t b3lyp/6-31g* opt=(gdiis,loose)

UMP_3405

0 1
P -2.1825 -0.9984 3.7915
O -1.9454 -0.6375 2.3978
O -2.3750 0.1786 4.6004
O -1.0651 -1.7440 4.3161
O -0.8117 -0.3815 -3.3291
O -2.2481 -2.1207 -1.7837
O -0.3112 0.1813 0.1337
O -3.3677 -1.8096 3.9122
O 2.5424 -0.6246 -0.7332
O 4.7817 3.0310 -1.1346
N 1.2993 1.2337 -1.1855
N 3.6052 1.2002 -0.9999
C -1.6925 -1.4576 1.3661
C 0.0249 0.5912 -1.2006
C -1.4457 -0.6887 0.0465
C -0.2117 -0.6774 -2.0690
C -1.0836 -1.5799 -1.1632
C 2.4510 0.5710 -0.9778
C 3.6805 2.4989 -1.1446
C 1.3751 2.5695 -1.3199
C 2.5464 3.2391 -1.2974
H -1.1165 -2.1384 5.0998
H -1.7153 0.7470 4.7282
H -0.1250 0.1090 -3.8281
H -1.9111 -2.7238 -2.4791
H 4.3961 0.7091 -0.9011
H -2.5402 -2.1317 1.2051
H -0.8068 -2.0655 1.5772
H -0.7684 1.2924 -1.5008
H -2.3428 -0.0951 -0.1722
H 0.7099 -1.2076 -2.3160
H -0.4811 -2.4302 -0.8276
H 0.5587 3.1296 -1.4288
H 2.5763 4.2304 -1.3824

--link1--
%mem=1gb
%nproc=10
%chk=temp.chk
#t pbe1pbe/3-21g** guess=read geom=checkpoint nmr

UMP_3405

0 1