--- atoms: - N 0 -12.781 3.620 15.274 - C 0 -11.976 4.652 15.944 - C 0 -12.722 6.019 15.985 - O 0 -13.133 6.378 14.897 - C 2 CBCA 3 CBCAC 4 CBCACO - C 5 CBCA 2 CBCAC 3 CG1CBCAC - C 5 CBCA 2 CBCAC 6 CG2CBCAC vars: CBCA : 1.54 CBCAC : 113.4 CBCACO : 71.8 CG1CBCAC : [0, 25, 40, 55, 70, 90, 105, 130, 145, 170, 180 ] CG2CBCAC : 120.