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. 2024 Jun 28;9(Pt 6):x240615. doi: 10.1107/S2414314624006151
x y z Uiso*/Ueq
N3 0.20041 (7) 0.03150 (8) −0.0041 (4) 0.0233 (4)
C7 0.28868 (9) 0.15497 (9) 0.5132 (4) 0.0252 (4)
H7 0.3324 0.1604 0.5071 0.030*
C1 0.39265 (9) −0.01777 (9) −0.5063 (4) 0.0270 (4)
H1 0.4315 −0.0032 −0.5689 0.032*
N2 0.29394 (8) 0.07934 (7) 0.1587 (3) 0.0217 (3)
C13 0.10022 (9) 0.05895 (9) 0.1820 (4) 0.0267 (4)
H13 0.0797 0.0324 0.0611 0.032*
C10 0.15895 (9) 0.14042 (9) 0.5376 (4) 0.0255 (4)
C15 0.19455 (9) 0.10642 (8) 0.3491 (4) 0.0219 (4)
C5 0.31573 (9) −0.08947 (9) −0.5129 (4) 0.0273 (4)
H5 0.2989 −0.1270 −0.5796 0.033*
C6 0.26012 (9) 0.11421 (8) 0.3414 (4) 0.0218 (4)
C14 0.16387 (9) 0.06513 (9) 0.1728 (4) 0.0231 (4)
C11 0.09363 (10) 0.13134 (9) 0.5452 (4) 0.0288 (5)
H11 0.0693 0.1527 0.6721 0.035*
B1 0.26579 (10) 0.03753 (10) −0.0181 (4) 0.0220 (4)
C3 0.30411 (9) −0.00146 (9) −0.2242 (4) 0.0220 (4)
C4 0.28147 (9) −0.05701 (9) −0.3271 (4) 0.0262 (4)
H4 0.2426 −0.0727 −0.2700 0.031*
C12 0.06564 (9) 0.09191 (9) 0.3700 (4) 0.0286 (5)
H12 0.0219 0.0868 0.3758 0.034*
N1 0.37087 (8) −0.07118 (8) −0.6036 (3) 0.0268 (4)
C2 0.36184 (9) 0.01756 (9) −0.3191 (4) 0.0246 (4)
H2A 0.3801 0.0547 −0.2555 0.030*
C9 0.19006 (10) 0.18127 (9) 0.7109 (4) 0.0277 (5)
H9 0.1670 0.2039 0.8380 0.033*
C8 0.25310 (10) 0.18841 (9) 0.6969 (4) 0.0279 (4)
H8 0.2732 0.2164 0.8132 0.033*
H3 0.1804 (12) 0.0058 (12) −0.125 (6) 0.042 (7)*
H2 0.3364 (11) 0.0870 (10) 0.167 (5) 0.028 (6)*