Supplementary material for González-Luque (2000) Proc. Natl. Acad. Sci. USA 97 (17), 9379-9384.

Table 7.

Cartesian coordinates (Å) for the planar SP structure of model 2

C

.653046

.002557

.000000

C

-.695734

.061426

.000000

C

1.527062

1.205269

.000000

H

1.145783

-.955107

.000000

C

-1.540455

-1.142297

.000000

H

-1.199891

1.012164

.000000

C

2.900845

1.125558

.000000

H

1.052615

2.170822

.000000

C

-2.922487

-1.112559

.000000

H

-1.042860

-2.096776

.000000

N

3.719608

2.189295

.000000

H

3.396541

.172934

.000000

C

-3.685419

-2.279384

.000000

H

-3.428028

-.163197

.000000

H

3.370779

3.124410

.000000

H

4.710035

2.078189

.000000

H

-3.222684

-3.248447

.000000

H

-4.757280

-2.243007

.000000