Skip to main content
. 2010 Nov 6;66(Pt 12):m1520. doi: 10.1107/S160053681004479X
x y z Uiso*/Ueq
Zn1 0.44360 (3) −0.13668 (2) 0.00434 (2) 0.03250 (11)
N1 0.3373 (2) −0.18995 (19) 0.13387 (19) 0.0385 (4)
N2 0.3198 (2) −0.09350 (19) 0.24246 (19) 0.0364 (4)
O6 0.40890 (17) 0.04471 (14) 0.07488 (15) 0.0331 (3)
O7 0.6260 (2) −0.21497 (19) 0.07459 (19) 0.0528 (5)
H7A 0.6208 −0.2359 0.1393 0.079*
C5 0.2447 (4) −0.4353 (3) 0.0179 (3) 0.0597 (7)
H5A 0.2756 −0.4202 −0.0538 0.089*
H5B 0.1397 −0.4941 −0.0135 0.089*
H5C 0.3182 −0.4748 0.0544 0.089*
C6 0.2460 (3) −0.3054 (2) 0.1218 (2) 0.0413 (5)
C7 0.1694 (3) −0.2813 (3) 0.2213 (3) 0.0453 (6)
H7 0.0970 −0.3442 0.2334 0.054*
C8 0.2202 (3) −0.1478 (3) 0.2983 (2) 0.0413 (5)
C9 0.1855 (4) −0.0683 (3) 0.4239 (3) 0.0606 (8)
H9A 0.2773 −0.0431 0.4961 0.091*
H9B 0.0971 −0.1210 0.4368 0.091*
H9C 0.1599 0.0104 0.4193 0.091*
C10 0.4166 (3) 0.0433 (2) 0.2899 (2) 0.0381 (5)
H10A 0.5279 0.0435 0.3030 0.046*
H10B 0.4016 0.0957 0.3743 0.046*
C11 0.3753 (3) 0.1084 (2) 0.1951 (2) 0.0331 (5)
H11 0.2605 0.0997 0.1770 0.040*
C13 0.7924 (3) −0.1751 (4) 0.0899 (3) 0.0641 (8)
H13A 0.8108 −0.1760 0.0076 0.077*
H13B 0.8423 −0.2383 0.1110 0.077*
C14 0.8653 (5) −0.0412 (4) 0.1945 (6) 0.1128 (18)
H14A 0.8059 0.0190 0.1808 0.169*
H14B 0.9729 −0.0113 0.1926 0.169*
H14C 0.8647 −0.0439 0.2783 0.169*
C12 0.4601 (3) 0.2576 (2) 0.2567 (2) 0.0367 (5)
H12A 0.4222 0.2976 0.1977 0.044*
H12B 0.4328 0.2998 0.3385 0.044*
N3 0.7009 (2) 0.25422 (18) 0.17989 (19) 0.0366 (4)
N4 0.6328 (2) 0.28347 (18) 0.28297 (18) 0.0359 (4)
C1 0.7043 (4) 0.3867 (3) 0.5278 (3) 0.0630 (8)
H1A 0.6439 0.4506 0.5295 0.094*
H1B 0.8007 0.4283 0.5977 0.094*
H1C 0.6428 0.3136 0.5389 0.094*
C2 0.7442 (3) 0.3366 (2) 0.3990 (2) 0.0437 (6)
C3 0.8885 (3) 0.3381 (3) 0.3704 (3) 0.0501 (6)
H3 0.9877 0.3674 0.4306 0.060*
C15 0.9736 (3) 0.2689 (3) 0.1524 (3) 0.0614 (8)
H15A 0.9241 0.1944 0.0696 0.092*
H15B 1.0653 0.2525 0.1974 0.092*
H15C 1.0055 0.3479 0.1373 0.092*
C4 0.8579 (3) 0.2875 (2) 0.2346 (3) 0.0433 (6)
O1 0.7169 (4) −0.2927 (3) 0.4897 (3) 0.1003 (9)
O2 0.5741 (4) −0.4532 (3) 0.2842 (4) 0.1233 (12)
O3 0.6271 (4) −0.2330 (3) 0.3209 (3) 0.0955 (9)
O4 0.8318 (4) −0.3383 (4) 0.3177 (3) 0.1242 (12)
Cl1 0.68858 (8) −0.33052 (6) 0.35237 (7) 0.05214 (18)