x	y	z	Uiso*/Ueq
C1	0.7657 (6)	0.03465 (19)	0.9184 (5)	0.0691 (15)
H1	0.8154	0.0179	0.8693	0.083*
C2	0.6000 (5)	0.03845 (18)	0.8828 (4)	0.0554 (13)
C3	0.5296 (5)	0.06379 (18)	0.9592 (4)	0.0551 (13)
C4	0.6183 (6)	0.08559 (19)	1.0686 (5)	0.0670 (14)
H4	0.5697	0.1026	1.1180	0.080*
C5	0.7824 (7)	0.0810 (2)	1.1012 (5)	0.0804 (17)
H5	0.8467	0.0950	1.1747	0.096*
C6	0.8542 (6)	0.0558 (2)	1.0266 (6)	0.0785 (17)
H6	0.9655	0.0534	1.0513	0.094*
C7	0.3447 (6)	0.0363 (2)	0.7922 (4)	0.0603 (13)
C8	0.1824 (2)	0.02679 (8)	0.70124 (17)	0.0900 (19)
H8A	0.1014	0.0396	0.7326	0.135*
H8B	0.1675	−0.0099	0.6858	0.135*
H8C	0.1742	0.0446	0.6269	0.135*
C9	−0.8388 (2)	0.22467 (8)	0.63617 (17)	0.0538 (13)
C10	−0.9846 (2)	0.24529 (8)	0.63617 (17)	0.0691 (15)
H10	−1.0804	0.2309	0.5863	0.083*
C11	−0.9873 (2)	0.28737 (8)	0.71070 (17)	0.0743 (16)
H11	−1.0849	0.3012	0.7107	0.089*
C12	−0.8442 (2)	0.30882 (8)	0.78523 (17)	0.0753 (16)
H12	−0.8460	0.3370	0.8351	0.090*
C13	−0.6984 (2)	0.28820 (8)	0.78522 (17)	0.0648 (14)
H13	−0.6027	0.3026	0.8351	0.078*
C14	−0.6957 (2)	0.24613 (8)	0.71069 (17)	0.0497 (12)
C15	−0.6463 (6)	0.18141 (19)	0.6109 (4)	0.0615 (14)
C16	−0.5526 (6)	0.1420 (2)	0.5672 (5)	0.0935 (19)
H16A	−0.6243	0.1222	0.5018	0.140*
H16B	−0.4981	0.1190	0.6327	0.140*
H16C	−0.4752	0.1595	0.5389	0.140*
C17	−0.4031 (5)	0.22546 (18)	0.7553 (4)	0.0645 (15)
H17A	−0.3820	0.2618	0.7778	0.077*
H17B	−0.3447	0.2165	0.7005	0.077*
C18	−0.3436 (5)	0.19203 (18)	0.8684 (4)	0.0582 (13)
H18A	−0.4014	0.2013	0.9234	0.070*
H18B	−0.3664	0.1558	0.8459	0.070*
C19	−0.1661 (5)	0.19827 (19)	0.9332 (4)	0.0640 (14)
H19A	−0.1407	0.2351	0.9376	0.077*
H19B	−0.1423	0.1857	1.0158	0.077*
C20	−0.0576 (5)	0.17074 (18)	0.8769 (5)	0.0549 (13)
C21	0.1192 (5)	0.17729 (19)	0.9435 (4)	0.0640 (14)
H21A	0.1390	0.1687	1.0283	0.077*
H21B	0.1459	0.2138	0.9401	0.077*
C22	0.2331 (5)	0.14550 (19)	0.8985 (4)	0.0629 (14)
H22A	0.1977	0.1470	0.8104	0.075*
H22B	0.3391	0.1611	0.9286	0.075*
C23	0.2449 (5)	0.08920 (19)	0.9373 (4)	0.0656 (14)
H23A	0.2737	0.0873	1.0251	0.079*
H23B	0.1413	0.0725	0.9021	0.079*
N1	−0.8030 (5)	0.18326 (15)	0.5730 (3)	0.0632 (11)
N2	−0.5748 (4)	0.21841 (15)	0.6929 (3)	0.0551 (11)
N3	0.3650 (4)	0.06156 (15)	0.8987 (4)	0.0570 (11)
N4	0.4803 (5)	0.02109 (15)	0.7805 (4)	0.0659 (12)
O1	−0.1070 (3)	0.14430 (13)	0.7855 (3)	0.0654 (10)
O1W	0.5198 (5)	−0.06286 (16)	0.6451 (4)	0.1008 (14)
H1A	0.548 (7)	−0.0316 (14)	0.687 (4)	0.151*
H1B	0.455 (7)	−0.052 (2)	0.570 (3)	0.151*
O2W	0.2025 (6)	0.02126 (17)	0.3906 (5)	0.1258 (18)
H2A	0.308 (3)	0.028 (3)	0.425 (5)	0.189*
H2B	0.155 (7)	0.0522 (16)	0.366 (8)	0.189*
O3W	0.7904 (5)	0.08554 (17)	0.5440 (4)	0.0971 (13)
H3A	0.780 (8)	0.0512 (11)	0.559 (6)	0.146*
H3B	0.825 (8)	0.099 (3)	0.618 (3)	0.146*
O4W	0.2093 (7)	0.1308 (3)	0.2426 (5)	0.153 (2)
H4A	0.129 (7)	0.126 (4)	0.276 (8)	0.229*
H4B	0.289 (7)	0.109 (3)	0.289 (8)	0.229*
O5W	0.5163 (4)	0.39697 (15)	0.9246 (3)	0.0828 (12)
H5A	0.457 (6)	0.404 (3)	0.973 (5)	0.124*
H5B	0.576 (6)	0.3710 (17)	0.968 (5)	0.124*