NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 4.0468 8.0393 120.3925 62.0657 32.5957 175.2374 2 P 4.3448 0.0000 0.0000 59.4212 32.2548 173.5180 3 P 4.3173 0.0000 0.0000 62.1212 32.4003 175.7925 4 P 4.4164 0.0000 0.0000 62.0617 32.3085 175.7023 5 V 4.1648 7.9694 119.7786 60.4451 32.1610 174.0524 6 P 4.4754 0.0000 0.0000 61.5077 31.9042 174.4942 7 P 4.4488 0.0000 0.0000 62.6213 31.8809 177.0978 8 R 3.8705 8.4264 120.3911 57.3285 30.3244 175.4257 9 R 4.1697 8.0934 120.8764 56.0869 30.8298 175.6894 10 R 4.1221 8.4403 119.6382 56.5075 29.6470 176.2027 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 1 V 8.04 4.05 2.08 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 1.01 0.00 0.00 0.93 0.00 0.00 2 P 0.00 4.34 0.00 2.30 2.03 0.00 3.82 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.01 0.00 3 P 0.00 4.32 0.00 2.20 2.12 0.00 3.76 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 4 P 0.00 4.42 0.00 2.20 2.08 0.00 3.74 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.94 0.00 5 V 7.97 4.16 2.08 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 0.80 0.00 0.00 0.93 0.00 0.00 6 P 0.00 4.48 0.00 2.08 1.97 0.00 3.73 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.07 0.00 7 P 0.00 4.45 0.00 2.17 2.05 0.00 3.77 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.98 0.00 8 R 8.43 3.87 0.00 1.82 2.04 0.00 3.24 0.00 0.00 3.15 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 9 R 8.09 4.17 0.00 1.93 2.06 0.00 3.23 0.00 0.00 3.28 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.59 0.00 10 R 8.44 4.12 0.00 1.96 1.90 0.00 3.12 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.62 0.00