Aceton with given rho beta gamma ntop 2 ncyc 2 ints 3 BJ 6.711547500 BK 3.455930500 B- 1.803585500 F 167.600893280 167.600893280 rho .062257579 .062257579 beta .446445707 -0.446445707 gamma .000000000 .000000000 V1n 7981.026914845 7981.026914845 mu_x 1.0 G 0 0 G 0 1 G 1 1 G 1 -1 V 0 0 J 3