NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1B G 3.8960 8.3544 109.7364 45.0383 0.0000 173.5678 1A L 3.9459 8.2504 117.4422 54.3617 42.0755 176.2235 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1B G 8.35 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1A L 8.25 3.95 0.00 1.70 1.55 0.92 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00