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. 2008 Jul 26;64(Pt 8):m1062. doi: 10.1107/S1600536808022812
x y z Uiso*/Ueq
Cu 0.209657 (18) 0.90493 (2) 0.156116 (9) 0.02440 (7)
N1 0.21922 (12) 0.80402 (17) 0.05966 (6) 0.0257 (3)
N2 0.42113 (13) 0.89494 (17) 0.14606 (7) 0.0275 (3)
C1 0.11886 (17) 0.7632 (2) 0.01841 (9) 0.0325 (4)
C2 0.1317 (2) 0.6999 (3) −0.04910 (10) 0.0472 (5)
H2A 0.0605 0.6741 −0.0778 0.057*
C3 0.2471 (2) 0.6765 (3) −0.07224 (10) 0.0508 (5)
H3A 0.2552 0.6332 −0.1165 0.061*
C4 0.35505 (19) 0.7178 (3) −0.02912 (9) 0.0393 (4)
C5 0.4803 (2) 0.6986 (3) −0.04949 (11) 0.0541 (6)
H5A 0.4929 0.6540 −0.0931 0.065*
C6 0.5804 (2) 0.7435 (3) −0.00711 (11) 0.0537 (6)
H6A 0.6609 0.7298 −0.0217 0.064*
C7 0.56433 (17) 0.8120 (3) 0.05998 (10) 0.0397 (4)
C8 0.66470 (19) 0.8661 (3) 0.10598 (12) 0.0511 (5)
H8A 0.7468 0.8577 0.0931 0.061*
C9 0.64241 (19) 0.9302 (3) 0.16884 (12) 0.0478 (5)
H9A 0.7091 0.9659 0.1992 0.057*
C10 0.51845 (17) 0.9430 (2) 0.18838 (9) 0.0350 (4)
C11 0.44274 (15) 0.8321 (2) 0.08260 (8) 0.0289 (3)
C12 0.33615 (16) 0.7831 (2) 0.03694 (8) 0.0281 (3)
C13 −0.00801 (18) 0.7856 (3) 0.04536 (10) 0.0438 (4)
H13A −0.0302 0.6831 0.0694 0.066*
H13B −0.0691 0.8066 0.0073 0.066*
H13C −0.0062 0.8816 0.0767 0.066*
C14 0.4920 (2) 1.0068 (3) 0.25888 (10) 0.0537 (6)
H14A 0.4243 1.0884 0.2547 0.081*
H14B 0.5659 1.0614 0.2802 0.081*
H14C 0.4691 0.9116 0.2870 0.081*
O1 0.18364 (13) 0.98991 (18) 0.24857 (6) 0.0408 (3)
O2 −0.02000 (15) 1.0452 (3) 0.22488 (8) 0.0613 (4)
C15 0.0760 (2) 1.0407 (3) 0.26275 (10) 0.0471 (5)
O3 0.18495 (13) 1.12747 (15) 0.10994 (6) 0.0365 (3)
O4 0.18327 (18) 1.41073 (16) 0.10823 (8) 0.0530 (4)
C16 0.19793 (18) 1.2723 (2) 0.13792 (9) 0.0360 (4)
O5 0.19568 (12) 0.67025 (15) 0.19376 (6) 0.0344 (3)
H5B 0.1958 0.5834 0.1636 0.051*
H5C 0.1416 0.6452 0.2242 0.054*
H15 0.0751 1.0904 0.3111 0.052*
H16 0.2383 1.2705 0.1852 0.049*