NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 4.0453 8.0549 120.3925 61.3778 31.7026 174.4753 2 P 4.1289 0.0000 0.0000 60.9693 32.0972 173.9875 3 P 4.3190 0.0000 0.0000 62.0743 32.8003 173.8594 4 P 4.4609 0.0000 0.0000 61.8831 31.8595 176.4827 5 V 3.7176 8.2371 123.6511 61.7488 32.1494 173.8967 6 P 4.3021 0.0000 0.0000 61.9036 31.7428 174.7173 7 P 4.3816 0.0000 0.0000 62.2073 30.6996 176.0569 8 R 4.3952 8.1392 123.8363 55.8408 31.7801 176.5549 9 R 4.6103 7.7225 116.3742 54.8092 31.5207 175.3921 10 R 4.0825 7.8950 122.2992 56.6524 30.1180 175.5465 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 8.05 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 0.99 0.00 0.00 0.93 0.00 0.00 2 P 0.00 4.13 0.00 2.16 2.00 0.00 3.76 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.16 0.00 3 P 0.00 4.32 0.00 2.03 2.01 0.00 3.67 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 2.03 2.10 0.00 4 P 0.00 4.46 0.00 2.17 2.06 0.00 3.77 0.00 0.00 3.58 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 8.24 3.72 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 0.77 0.00 0.00 0.93 0.00 0.00 6 P 0.00 4.30 0.00 2.08 1.97 0.00 3.72 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 2.02 2.07 0.00 7 P 0.00 4.38 0.00 2.17 2.10 0.00 3.75 0.00 0.00 3.58 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 8 R 8.14 4.40 0.00 1.77 1.88 0.00 3.32 0.00 0.00 3.22 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.75 0.00 9 R 7.72 4.61 0.00 1.80 1.83 0.00 3.26 0.00 0.00 3.15 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.59 0.00 10 R 7.89 4.08 0.00 1.75 1.80 0.00 3.31 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 1.61 1.68 0.00