NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1002 I 4.0687 8.0201 114.2703 60.0558 39.5774 175.2139 1003 A 3.9667 7.9404 127.0370 51.9781 18.1869 177.6048 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 1002 I 8.02 4.07 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.12 0.91 0.00 0.00 1003 A 7.94 3.97 1.28 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