____________________________________________________________________________ | | | E V A L - Internals and their errors from Cartesians | |____________________________________________________________________________| version 21.V.1999 Zbigniew KISIEL INPUT CARTESIANS: N' -1.19820 .00130 .68480 .00220 .00000 .00000 C(2) .00000 .00000 1.27910 .00120 .00000 .00000 N 1.19820 .00130 .68480 .00220 .00000 .00000 C(4) 1.18430 .00130 -.64680 .00230 .00000 .00000 C(5) .00000 .00000 -1.38040 .00110 .00000 .00000 C(6) -1.18430 .00130 -.64680 .00230 .00000 .00000 CALCULATED INTERNALS: C(2) N = 1.33749 +- .00161 N C(4) = 1.33167 +- .00318 C(4) C(5) = 1.39310 +- .00174 N' C(2) N = 127.23778 +- .26486 C(2) N C(4) = 115.78311 +- .30723 N C(4) C(5) = 122.37374 +- .33787 C(4) C(5) C(6) = 116.44878 +- .21744