N1—C2 | 1.472 (3) | C27—H27C | 0.9800 |
N1—C7 | 1.486 (3) | C27'—H27D | 0.9800 |
N1—C1 | 1.491 (3) | C27'—H27E | 0.9800 |
O1—C12 | 1.360 (4) | C27'—H27F | 0.9800 |
O1—H1 | 0.92 (4) | C25—C26 | 1.380 (4) |
O4—C3 | 1.402 (4) | C25—H25 | 0.9500 |
O4—H4 | 0.8400 | C26—H26 | 0.9500 |
O4'—C3 | 1.387 (6) | N2—C8 | 1.486 (4) |
O4'—H4' | 0.8400 | N2—C8' | 1.494 (8) |
C1—N2 | 1.467 (3) | O3—C34 | 1.382 (5) |
C1—C11 | 1.514 (4) | O3—C37 | 1.428 (5) |
C1—H1A | 1.0000 | C31—C36 | 1.381 (5) |
C2—C3 | 1.508 (4) | C31—C32 | 1.385 (4) |
C2—H2A | 0.9900 | C31—C8 | 1.499 (5) |
C2—H2B | 0.9900 | C32—C33 | 1.377 (4) |
C3—C4 | 1.504 (4) | C32—H32 | 0.9500 |
C3—H3 | 1.0000 | C33—C34 | 1.389 (7) |
C3—H3' | 1.0000 | C33—H33 | 0.9500 |
C4—N2 | 1.463 (4) | C34—C35 | 1.369 (7) |
C4—H4A | 0.9900 | C35—C36 | 1.398 (5) |
C4—H4B | 0.9900 | C35—H35 | 0.9500 |
C7—C21 | 1.508 (4) | C36—H36 | 0.9500 |
C7—H7A | 0.9900 | C37—H37A | 0.9800 |
C7—H7B | 0.9900 | C37—H37B | 0.9800 |
C11—C16 | 1.387 (3) | C37—H37C | 0.9800 |
C11—C12 | 1.400 (4) | C8—H8A | 0.9900 |
C12—C13 | 1.411 (4) | C8—H8B | 0.9900 |
C13—C14 | 1.372 (4) | O3'—C34' | 1.388 (14) |
C13—H13 | 0.9500 | O3'—C37' | 1.443 (15) |
C14—C15 | 1.359 (4) | C31'—C32' | 1.378 (12) |
C14—H14 | 0.9500 | C31'—C36' | 1.400 (12) |
C15—C16 | 1.389 (4) | C31'—C8' | 1.508 (15) |
C15—H15 | 0.9500 | C32'—C33' | 1.47 (3) |
C16—H16 | 0.9500 | C32'—H32' | 0.9500 |
C21—C22 | 1.390 (4) | C33'—C34' | 1.38 (4) |
C21—C26 | 1.392 (4) | C33'—H33' | 0.9500 |
C22—C23 | 1.381 (4) | C34'—C35' | 1.396 (12) |
C22—H22 | 0.9500 | C35'—C36' | 1.380 (11) |
C23—C24 | 1.382 (4) | C35'—H35' | 0.9500 |
C23—H23 | 0.9500 | C36'—H36' | 0.9500 |
C24—O2 | 1.378 (3) | C37'—H37D | 0.9800 |
C24—C25 | 1.387 (4) | C37'—H37E | 0.9800 |
O2—C27 | 1.440 (5) | C37'—H37F | 0.9800 |
O2—C27' | 1.459 (16) | C8'—H8C | 0.9900 |
C27—H27A | 0.9800 | C8'—H8D | 0.9900 |
C27—H27B | 0.9800 | ||
C2—N1—C7 | 109.8 (2) | O2—C27'—H27D | 109.5 |
C2—N1—C1 | 112.8 (2) | O2—C27'—H27E | 109.5 |
C7—N1—C1 | 109.24 (18) | H27D—C27'—H27E | 109.5 |
C12—O1—H1 | 114 (2) | O2—C27'—H27F | 109.5 |
C3—O4—H4 | 109.5 | H27D—C27'—H27F | 109.5 |
C3—O4'—H4' | 109.5 | H27E—C27'—H27F | 109.5 |
N2—C1—N1 | 109.64 (18) | C26—C25—C24 | 119.9 (3) |
N2—C1—C11 | 109.2 (2) | C26—C25—H25 | 120.0 |
N1—C1—C11 | 109.1 (2) | C24—C25—H25 | 120.0 |
N2—C1—H1A | 109.6 | C25—C26—C21 | 121.6 (2) |
N1—C1—H1A | 109.6 | C25—C26—H26 | 119.2 |
C11—C1—H1A | 109.6 | C21—C26—H26 | 119.2 |
N1—C2—C3 | 109.9 (2) | C4—N2—C1 | 113.6 (2) |
N1—C2—H2A | 109.7 | C4—N2—C8 | 106.1 (2) |
C3—C2—H2A | 109.7 | C1—N2—C8 | 110.4 (2) |
N1—C2—H2B | 109.7 | C4—N2—C8' | 120.4 (8) |
C3—C2—H2B | 109.7 | C1—N2—C8' | 111.3 (7) |
H2A—C2—H2B | 108.2 | C34—O3—C37 | 117.1 (4) |
O4'—C3—C4 | 105.0 (4) | C36—C31—C32 | 117.3 (3) |
O4—C3—C4 | 110.5 (3) | C36—C31—C8 | 121.4 (3) |
O4'—C3—C2 | 112.2 (4) | C32—C31—C8 | 121.2 (3) |
O4—C3—C2 | 109.8 (3) | C33—C32—C31 | 122.0 (3) |
C4—C3—C2 | 109.3 (2) | C33—C32—H32 | 119.0 |
O4—C3—H3 | 109.0 | C31—C32—H32 | 119.0 |
C4—C3—H3 | 109.0 | C32—C33—C34 | 119.5 (4) |
C2—C3—H3 | 109.0 | C32—C33—H33 | 120.2 |
O4'—C3—H3' | 110.1 | C34—C33—H33 | 120.2 |
C4—C3—H3' | 110.1 | C35—C34—O3 | 124.9 (5) |
C2—C3—H3' | 110.1 | C35—C34—C33 | 120.1 (4) |
N2—C4—C3 | 110.2 (2) | O3—C34—C33 | 115.0 (5) |
N2—C4—H4A | 109.6 | C34—C35—C36 | 119.3 (4) |
C3—C4—H4A | 109.6 | C34—C35—H35 | 120.4 |
N2—C4—H4B | 109.6 | C36—C35—H35 | 120.4 |
C3—C4—H4B | 109.6 | C31—C36—C35 | 121.8 (3) |
H4A—C4—H4B | 108.1 | C31—C36—H36 | 119.1 |
N1—C7—C21 | 112.9 (2) | C35—C36—H36 | 119.1 |
N1—C7—H7A | 109.0 | O3—C37—H37A | 109.5 |
C21—C7—H7A | 109.0 | O3—C37—H37B | 109.5 |
N1—C7—H7B | 109.0 | H37A—C37—H37B | 109.5 |
C21—C7—H7B | 109.0 | O3—C37—H37C | 109.5 |
H7A—C7—H7B | 107.8 | H37A—C37—H37C | 109.5 |
C16—C11—C12 | 117.8 (3) | H37B—C37—H37C | 109.5 |
C16—C11—C1 | 121.6 (2) | N2—C8—C31 | 113.1 (3) |
C12—C11—C1 | 120.6 (2) | N2—C8—H8A | 109.0 |
O1—C12—C11 | 121.6 (3) | C31—C8—H8A | 109.0 |
O1—C12—C13 | 119.0 (3) | N2—C8—H8B | 109.0 |
C11—C12—C13 | 119.4 (3) | C31—C8—H8B | 109.0 |
C14—C13—C12 | 120.3 (3) | H8A—C8—H8B | 107.8 |
C14—C13—H13 | 119.8 | C34'—O3'—C37' | 113.6 (14) |
C12—C13—H13 | 119.8 | C32'—C31'—C36' | 120.7 (12) |
C15—C14—C13 | 121.1 (3) | C32'—C31'—C8' | 123.3 (12) |
C15—C14—H14 | 119.5 | C36'—C31'—C8' | 116.0 (11) |
C13—C14—H14 | 119.5 | C31'—C32'—C33' | 118.4 (17) |
C14—C15—C16 | 119.0 (3) | C31'—C32'—H32' | 120.8 |
C14—C15—H15 | 120.5 | C33'—C32'—H32' | 120.8 |
C16—C15—H15 | 120.5 | C34'—C33'—C32' | 119 (2) |
C11—C16—C15 | 122.4 (3) | C34'—C33'—H33' | 120.7 |
C11—C16—H16 | 118.8 | C32'—C33'—H33' | 120.7 |
C15—C16—H16 | 118.8 | C33'—C34'—O3' | 124.6 (16) |
C22—C21—C26 | 117.3 (2) | C33'—C34'—C35' | 121.9 (17) |
C22—C21—C7 | 121.9 (2) | O3'—C34'—C35' | 113.5 (11) |
C26—C21—C7 | 120.8 (2) | C36'—C35'—C34' | 119.1 (12) |
C23—C22—C21 | 121.7 (3) | C36'—C35'—H35' | 120.4 |
C23—C22—H22 | 119.1 | C34'—C35'—H35' | 120.4 |
C21—C22—H22 | 119.1 | C35'—C36'—C31' | 121.2 (11) |
C22—C23—C24 | 120.0 (2) | C35'—C36'—H36' | 119.4 |
C22—C23—H23 | 120.0 | C31'—C36'—H36' | 119.4 |
C24—C23—H23 | 120.0 | O3'—C37'—H37D | 109.5 |
O2—C24—C23 | 125.3 (2) | O3'—C37'—H37E | 109.5 |
O2—C24—C25 | 115.2 (3) | H37D—C37'—H37E | 109.5 |
C23—C24—C25 | 119.4 (3) | O3'—C37'—H37F | 109.5 |
C24—O2—C27 | 116.8 (4) | H37D—C37'—H37F | 109.5 |
C24—O2—C27' | 116.8 (16) | H37E—C37'—H37F | 109.5 |
O2—C27—H27A | 109.5 | N2—C8'—C31' | 115.0 (11) |
O2—C27—H27B | 109.5 | N2—C8'—H8C | 108.5 |
H27A—C27—H27B | 109.5 | C31'—C8'—H8C | 108.5 |
O2—C27—H27C | 109.5 | N2—C8'—H8D | 108.5 |
H27A—C27—H27C | 109.5 | C31'—C8'—H8D | 108.5 |
H27B—C27—H27C | 109.5 | H8C—C8'—H8D | 107.5 |
C2—N1—C1—N2 | −54.3 (3) | C22—C21—C26—C25 | −0.4 (4) |
C7—N1—C1—N2 | −176.7 (2) | C7—C21—C26—C25 | 179.7 (2) |
C2—N1—C1—C11 | −173.8 (2) | C3—C4—N2—C1 | −57.1 (3) |
C7—N1—C1—C11 | 63.8 (3) | C3—C4—N2—C8 | −178.6 (2) |
C7—N1—C2—C3 | 179.1 (2) | C3—C4—N2—C8' | 167.1 (7) |
C1—N1—C2—C3 | 57.0 (3) | N1—C1—N2—C4 | 54.3 (3) |
N1—C2—C3—O4' | −173.5 (4) | C11—C1—N2—C4 | 173.8 (2) |
N1—C2—C3—O4 | 63.9 (3) | N1—C1—N2—C8 | 173.5 (2) |
N1—C2—C3—C4 | −57.5 (3) | C11—C1—N2—C8 | −67.1 (3) |
O4'—C3—C4—N2 | 177.8 (4) | N1—C1—N2—C8' | −165.8 (8) |
O4—C3—C4—N2 | −63.8 (3) | C11—C1—N2—C8' | −46.4 (8) |
C2—C3—C4—N2 | 57.2 (3) | C36—C31—C32—C33 | −1.3 (5) |
C2—N1—C7—C21 | 58.8 (3) | C8—C31—C32—C33 | 175.7 (3) |
C1—N1—C7—C21 | −177.1 (2) | C31—C32—C33—C34 | 0.6 (7) |
N2—C1—C11—C16 | 107.0 (3) | C37—O3—C34—C35 | 2.8 (10) |
N1—C1—C11—C16 | −133.2 (2) | C37—O3—C34—C33 | −176.7 (5) |
N2—C1—C11—C12 | −69.9 (3) | C32—C33—C34—C35 | 0.4 (9) |
N1—C1—C11—C12 | 49.9 (3) | C32—C33—C34—O3 | 179.9 (5) |
C16—C11—C12—O1 | 177.4 (3) | O3—C34—C35—C36 | 179.9 (6) |
C1—C11—C12—O1 | −5.6 (4) | C33—C34—C35—C36 | −0.6 (10) |
C16—C11—C12—C13 | −1.7 (4) | C32—C31—C36—C35 | 1.1 (6) |
C1—C11—C12—C13 | 175.3 (3) | C8—C31—C36—C35 | −175.9 (4) |
O1—C12—C13—C14 | −178.5 (3) | C34—C35—C36—C31 | −0.2 (7) |
C11—C12—C13—C14 | 0.6 (4) | C4—N2—C8—C31 | −72.2 (4) |
C12—C13—C14—C15 | 0.7 (5) | C1—N2—C8—C31 | 164.2 (3) |
C13—C14—C15—C16 | −0.7 (4) | C36—C31—C8—N2 | −43.1 (5) |
C12—C11—C16—C15 | 1.8 (4) | C32—C31—C8—N2 | 140.1 (4) |
C1—C11—C16—C15 | −175.3 (2) | C36'—C31'—C32'—C33' | −4 (3) |
C14—C15—C16—C11 | −0.5 (4) | C8'—C31'—C32'—C33' | 175 (2) |
N1—C7—C21—C22 | 57.9 (3) | C31'—C32'—C33'—C34' | 5 (4) |
N1—C7—C21—C26 | −122.3 (3) | C32'—C33'—C34'—O3' | 177 (2) |
C26—C21—C22—C23 | 0.8 (4) | C32'—C33'—C34'—C35' | −4 (4) |
C7—C21—C22—C23 | −179.3 (2) | C37'—O3'—C34'—C33' | 7 (3) |
C21—C22—C23—C24 | −0.2 (4) | C37'—O3'—C34'—C35' | −172.6 (18) |
C22—C23—C24—O2 | 178.5 (3) | C33'—C34'—C35'—C36' | 1 (3) |
C22—C23—C24—C25 | −0.9 (4) | O3'—C34'—C35'—C36' | −179.2 (13) |
C23—C24—O2—C27 | 1.4 (10) | C34'—C35'—C36'—C31' | 0 (2) |
C25—C24—O2—C27 | −179.2 (9) | C32'—C31'—C36'—C35' | 2 (2) |
C23—C24—O2—C27' | −26 (3) | C8'—C31'—C36'—C35' | −177.4 (13) |
C25—C24—O2—C27' | 153 (3) | C4—N2—C8'—C31' | −66.0 (14) |
O2—C24—C25—C26 | −178.2 (2) | C1—N2—C8'—C31' | 157.2 (11) |
C23—C24—C25—C26 | 1.3 (4) | C32'—C31'—C8'—N2 | 108.9 (18) |
C24—C25—C26—C21 | −0.6 (4) | C36'—C31'—C8'—N2 | −72.1 (19) |