XN4
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C01 | C02 | sing | 1.53Å | 1.56Å | |
C02 | C03 | sing | 1.53Å | 1.55Å | |
C03 | C04 | sing | 1.53Å | 1.55Å | |
F15 | C14 | sing | 1.40Å | 1.38Å | |
C10 | C09 | doub | 1.38Å | 1.42Å | Aromatic |
C10 | C11 | sing | 1.38Å | 1.37Å | Aromatic |
N26 | C25 | sing | 1.34Å | 1.32Å | Aromatic |
N26 | C27 | doub | 1.31Å | 1.35Å | Aromatic |
C09 | C08 | sing | 1.39Å | 1.38Å | Aromatic |
C11 | C12 | doub | 1.39Å | 1.38Å | Aromatic |
C06 | C05 | sing | 1.53Å | 1.48Å | |
C06 | N07 | sing | 1.46Å | 1.48Å | |
C25 | C24 | doub | 1.35Å | 1.39Å | Aromatic |
C04 | C05 | sing | 1.53Å | 1.57Å | |
C05 | N22 | sing | 1.47Å | 1.42Å | |
C27 | N28 | sing | 1.35Å | 1.32Å | Aromatic |
C08 | N07 | sing | 1.40Å | 1.42Å | |
C08 | C18 | doub | 1.39Å | 1.38Å | Aromatic |
C12 | C18 | sing | 1.39Å | 1.43Å | Aromatic |
C12 | O13 | sing | 1.36Å | 1.42Å | |
C14 | O13 | sing | 1.43Å | 1.42Å | |
C14 | F16 | sing | 1.40Å | 1.35Å | |
C14 | F17 | sing | 1.40Å | 1.38Å | |
N07 | C19 | sing | 1.34Å | 1.50Å | |
C24 | N28 | sing | 1.37Å | 1.36Å | Aromatic |
C24 | C23 | sing | 1.51Å | 1.55Å | |
N28 | C29 | sing | 1.46Å | 1.49Å | |
C31 | C32 | doub | 1.38Å | 1.40Å | Aromatic |
C31 | C30 | sing | 1.38Å | 1.40Å | Aromatic |
C32 | C33 | sing | 1.38Å | 1.39Å | Aromatic |
N22 | C23 | sing | 1.47Å | 1.32Å | |
N22 | C21 | sing | 1.47Å | 1.34Å | |
C19 | C21 | sing | 1.50Å | 1.58Å | |
C19 | O20 | doub | 1.21Å | 1.19Å | |
C29 | C30 | sing | 1.51Å | 1.57Å | |
C30 | C36 | doub | 1.38Å | 1.39Å | Aromatic |
C33 | CL34 | sing | 1.74Å | 1.80Å | |
C33 | C35 | doub | 1.38Å | 1.40Å | Aromatic |
C36 | C35 | sing | 1.38Å | 1.40Å | Aromatic |
C10 | H1 | sing | 1.08Å | 1.08Å | |
C21 | H2 | sing | 1.09Å | 1.10Å | |
C21 | H3 | sing | 1.09Å | 1.10Å | |
C01 | H4 | sing | 1.09Å | 1.10Å | |
C01 | H5 | sing | 1.09Å | 1.10Å | |
C01 | H6 | sing | 1.09Å | 1.10Å | |
C02 | H7 | sing | 1.09Å | 1.10Å | |
C02 | H8 | sing | 1.09Å | 1.10Å | |
C03 | H9 | sing | 1.09Å | 1.10Å | |
C03 | H10 | sing | 1.09Å | 1.10Å | |
C04 | H11 | sing | 1.09Å | 1.10Å | |
C04 | H12 | sing | 1.09Å | 1.10Å | |
C05 | H13 | sing | 1.09Å | 1.10Å | |
C06 | H14 | sing | 1.09Å | 1.10Å | |
C06 | H15 | sing | 1.09Å | 1.10Å | |
C09 | H16 | sing | 1.08Å | 1.08Å | |
C11 | H17 | sing | 1.08Å | 1.08Å | |
C18 | H18 | sing | 1.08Å | 1.08Å | |
C23 | H19 | sing | 1.09Å | 1.10Å | |
C23 | H20 | sing | 1.09Å | 1.10Å | |
C25 | H21 | sing | 1.08Å | 1.08Å | |
C27 | H22 | sing | 1.08Å | 1.08Å | |
C29 | H23 | sing | 1.09Å | 1.10Å | |
C29 | H24 | sing | 1.09Å | 1.10Å | |
C31 | H25 | sing | 1.08Å | 1.08Å | |
C32 | H26 | sing | 1.08Å | 1.08Å | |
C35 | H27 | sing | 1.08Å | 1.08Å | |
C36 | H28 | sing | 1.08Å | 1.08Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C01 | C02 | C03 | 112.7° | 109.5° |
C02 | C01 | H4 | 109.5° | 109.4° |
C02 | C01 | H5 | 109.4° | 109.5° |
C02 | C01 | H6 | 109.5° | 109.4° |
C01 | C02 | H7 | 108.7° | 109.4° |
C01 | C02 | H8 | 108.6° | 109.5° |
C02 | C03 | C04 | 113.6° | 109.5° |
C03 | C02 | H7 | 108.6° | 109.5° |
C03 | C02 | H8 | 108.7° | 109.5° |
C02 | C03 | H9 | 108.4° | 109.5° |
C02 | C03 | H10 | 108.4° | 109.5° |
C03 | C04 | C05 | 109.4° | 109.5° |
C04 | C03 | H9 | 108.4° | 109.4° |
C04 | C03 | H10 | 108.4° | 109.5° |
C03 | C04 | H11 | 109.5° | 109.5° |
C03 | C04 | H12 | 109.5° | 109.5° |
F15 | C14 | O13 | 113.4° | 109.5° |
F15 | C14 | F16 | 106.9° | 109.4° |
F15 | C14 | F17 | 109.2° | 109.5° |
C09 | C10 | C11 | 120.6° | 120.1° |
C10 | C09 | C08 | 119.0° | 120.1° |
C09 | C10 | H1 | 119.7° | 120.0° |
C10 | C09 | H16 | 120.5° | 120.0° |
C10 | C11 | C12 | 121.0° | 120.1° |
C11 | C10 | H1 | 119.7° | 119.9° |
C10 | C11 | H17 | 119.5° | 119.9° |
C25 | N26 | C27 | 105.6° | 109.3° |
N26 | C25 | C24 | 109.7° | 108.0° |
N26 | C25 | H21 | 125.2° | 126.0° |
N26 | C27 | N28 | 111.7° | 108.7° |
N26 | C27 | H22 | 124.2° | 125.6° |
C09 | C08 | N07 | 118.6° | 120.1° |
C09 | C08 | C18 | 120.2° | 119.9° |
C08 | C09 | H16 | 120.5° | 120.0° |
C11 | C12 | C18 | 118.1° | 119.9° |
C11 | C12 | O13 | 121.8° | 120.0° |
C12 | C11 | H17 | 119.5° | 120.0° |
C05 | C06 | N07 | 116.3° | 110.1° |
C06 | C05 | C04 | 101.7° | 109.7° |
C06 | C05 | N22 | 112.3° | 108.8° |
C06 | C05 | H13 | 109.4° | 109.7° |
C05 | C06 | H14 | 107.7° | 109.4° |
C05 | C06 | H15 | 107.7° | 109.3° |
C06 | N07 | C08 | 120.0° | 118.5° |
C06 | N07 | C19 | 118.2° | 122.9° |
N07 | C06 | H14 | 107.7° | 109.3° |
N07 | C06 | H15 | 107.7° | 109.5° |
C25 | C24 | N28 | 106.0° | 106.9° |
C25 | C24 | C23 | 126.1° | 126.6° |
C24 | C25 | H21 | 125.1° | 126.0° |
C04 | C05 | N22 | 114.7° | 109.6° |
C05 | C04 | H11 | 109.5° | 109.5° |
C05 | C04 | H12 | 109.5° | 109.5° |
C04 | C05 | H13 | 108.2° | 109.6° |
C05 | N22 | C23 | 117.0° | 111.0° |
C05 | N22 | C21 | 112.1° | 110.2° |
N22 | C05 | H13 | 110.2° | 109.6° |
C27 | N28 | C24 | 107.0° | 107.2° |
C27 | N28 | C29 | 126.0° | 126.4° |
N28 | C27 | H22 | 124.1° | 125.7° |
N07 | C08 | C18 | 121.1° | 120.0° |
C08 | N07 | C19 | 121.8° | 118.5° |
C08 | C18 | C12 | 121.0° | 119.9° |
C08 | C18 | H18 | 119.5° | 120.1° |
C18 | C12 | O13 | 120.1° | 120.0° |
C12 | C18 | H18 | 119.5° | 120.0° |
C12 | O13 | C14 | 120.1° | 117.0° |
O13 | C14 | F16 | 108.2° | 109.5° |
O13 | C14 | F17 | 109.8° | 109.5° |
F16 | C14 | F17 | 109.2° | 109.5° |
N07 | C19 | C21 | 115.8° | 122.7° |
N07 | C19 | O20 | 122.3° | 118.6° |
N28 | C24 | C23 | 127.8° | 126.6° |
C24 | N28 | C29 | 126.9° | 126.4° |
C24 | C23 | N22 | 116.3° | 109.5° |
C24 | C23 | H19 | 107.7° | 109.5° |
C24 | C23 | H20 | 107.7° | 109.5° |
N28 | C29 | C30 | 116.2° | 109.5° |
N28 | C29 | H23 | 107.8° | 109.5° |
N28 | C29 | H24 | 107.7° | 109.4° |
C32 | C31 | C30 | 121.1° | 120.0° |
C31 | C32 | C33 | 119.3° | 119.9° |
C32 | C31 | H25 | 119.4° | 120.0° |
C31 | C32 | H26 | 120.3° | 120.0° |
C31 | C30 | C29 | 121.5° | 120.0° |
C31 | C30 | C36 | 118.7° | 120.0° |
C30 | C31 | H25 | 119.5° | 120.0° |
C32 | C33 | CL34 | 119.4° | 120.0° |
C32 | C33 | C35 | 120.4° | 120.0° |
C33 | C32 | H26 | 120.4° | 120.1° |
C23 | N22 | C21 | 111.4° | 111.1° |
N22 | C23 | H19 | 107.7° | 109.5° |
N22 | C23 | H20 | 107.7° | 109.5° |
N22 | C21 | C19 | 109.5° | 109.9° |
N22 | C21 | H2 | 109.5° | 109.4° |
N22 | C21 | H3 | 109.5° | 109.4° |
C21 | C19 | O20 | 121.7° | 118.7° |
C19 | C21 | H2 | 109.5° | 109.4° |
C19 | C21 | H3 | 109.5° | 109.4° |
C29 | C30 | C36 | 119.8° | 120.0° |
C30 | C29 | H23 | 107.8° | 109.4° |
C30 | C29 | H24 | 107.8° | 109.5° |
C30 | C36 | C35 | 121.1° | 120.0° |
C30 | C36 | H28 | 119.5° | 120.0° |
CL34 | C33 | C35 | 120.1° | 120.0° |
C33 | C35 | C36 | 119.4° | 120.0° |
C33 | C35 | H27 | 120.3° | 120.0° |
C36 | C35 | H27 | 120.3° | 120.0° |
C35 | C36 | H28 | 119.4° | 120.0° |
H2 | C21 | H3 | 109.4° | 109.4° |
H4 | C01 | H5 | 109.5° | 109.5° |
H4 | C01 | H6 | 109.4° | 109.5° |
H5 | C01 | H6 | 109.5° | 109.5° |
H7 | C02 | H8 | 109.5° | 109.5° |
H9 | C03 | H10 | 109.5° | 109.5° |
H11 | C04 | H12 | 109.5° | 109.4° |
H14 | C06 | H15 | 109.5° | 109.3° |
H19 | C23 | H20 | 109.5° | 109.4° |
H23 | C29 | H24 | 109.5° | 109.4° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C01 | C02 | C03 | H7 | 120.5° | 119.9° |
C01 | C02 | C03 | H8 | 120.5° | 120.0° |
C01 | C02 | C03 | C04 | 134.7° | 180.0° |
C02 | C01 | H4 | H5 | 120.0° | 120.0° |
C02 | C01 | H4 | H6 | 120.0° | 120.0° |
C02 | C01 | H5 | H6 | 120.0° | 120.0° |
C01 | C02 | H7 | H8 | 118.5° | 120.0° |
C01 | C02 | C03 | H9 | 14.1° | 60.1° |
C01 | C02 | C03 | H10 | 104.7° | 60.0° |
C02 | C03 | C04 | H9 | 120.6° | 119.9° |
C02 | C03 | C04 | H10 | 120.6° | 120.0° |
C02 | C03 | C04 | C05 | 158.8° | 175.0° |
C03 | C02 | C01 | H4 | 180.0° | 180.0° |
C03 | C02 | C01 | H5 | 60.0° | 59.9° |
C03 | C02 | C01 | H6 | 60.0° | 60.1° |
C03 | C02 | H7 | H8 | 118.6° | 120.0° |
C02 | C03 | H9 | H10 | 118.1° | 120.0° |
C02 | C03 | C04 | H11 | 81.2° | 55.0° |
C02 | C03 | C04 | H12 | 38.8° | 64.9° |
C03 | C04 | C05 | C06 | 55.9° | 176.7° |
C03 | C04 | C05 | H11 | 120.0° | 120.0° |
C03 | C04 | C05 | H12 | 120.0° | 120.1° |
C03 | C04 | C05 | N22 | 177.4° | 63.9° |
C04 | C03 | C02 | H7 | 104.8° | 60.1° |
C04 | C03 | C02 | H8 | 14.3° | 60.0° |
C04 | C03 | H9 | H10 | 118.1° | 120.0° |
C03 | C04 | H11 | H12 | 120.0° | 120.0° |
C03 | C04 | C05 | H13 | 59.2° | 56.3° |
F15 | C14 | O13 | C12 | 57.2° | 180.0° |
F15 | C14 | O13 | F16 | 118.4° | 119.9° |
F15 | C14 | O13 | F17 | 122.5° | 120.1° |
F15 | C14 | F16 | F17 | 118.0° | 120.0° |
C09 | C10 | C11 | H1 | 180.0° | 179.8° |
C10 | C09 | C08 | H16 | 180.0° | 180.0° |
C09 | C10 | C11 | C12 | 0.2° | 0.1° |
C10 | C09 | C08 | N07 | 179.8° | 180.0° |
C10 | C09 | C08 | C18 | 0.4° | 0.0° |
C09 | C10 | C11 | H17 | 179.9° | 180.0° |
C11 | C10 | C09 | C08 | 0.1° | 0.1° |
C10 | C11 | C12 | H17 | 180.0° | 179.9° |
C10 | C11 | C12 | C18 | 0.3° | 0.0° |
C10 | C11 | C12 | O13 | 179.8° | 180.0° |
C11 | C10 | C09 | H16 | 179.9° | 179.9° |
N26 | C25 | C24 | H21 | 180.0° | 179.9° |
C25 | N26 | C27 | N28 | 0.2° | 0.0° |
N26 | C25 | C24 | N28 | 0.8° | 0.0° |
N26 | C25 | C24 | C23 | 178.9° | 179.7° |
C25 | N26 | C27 | H22 | 179.8° | 179.9° |
C27 | N26 | C25 | C24 | 0.6° | 0.0° |
N26 | C27 | N28 | H22 | 180.0° | 179.9° |
N26 | C27 | N28 | C24 | 0.3° | 0.1° |
N26 | C27 | N28 | C29 | 178.5° | 179.8° |
C27 | N26 | C25 | H21 | 179.4° | 179.9° |
C09 | C08 | N07 | C06 | 62.5° | 111.7° |
C09 | C08 | N07 | C18 | 179.4° | 180.0° |
C09 | C08 | C18 | C12 | 0.8° | 0.1° |
C09 | C08 | N07 | C19 | 115.3° | 68.3° |
C08 | C09 | C10 | H1 | 179.9° | 179.8° |
C09 | C08 | C18 | H18 | 179.2° | 180.0° |
C11 | C12 | C18 | C08 | 0.8° | 0.0° |
C11 | C12 | C18 | O13 | 179.6° | 180.0° |
C11 | C12 | O13 | C14 | 1.0° | 0.1° |
C12 | C11 | C10 | H1 | 179.8° | 179.7° |
C11 | C12 | C18 | H18 | 179.2° | 180.0° |
C05 | C06 | N07 | H14 | 121.0° | 120.1° |
C05 | C06 | N07 | H15 | 121.0° | 120.2° |
C06 | C05 | C04 | N22 | 121.4° | 119.3° |
C06 | C05 | C04 | H13 | 115.1° | 120.4° |
C06 | C05 | N22 | H13 | 122.2° | 119.9° |
C05 | C06 | N07 | C08 | 179.6° | 161.8° |
C05 | C06 | N07 | C19 | 2.6° | 18.2° |
C06 | C05 | N22 | C23 | 162.0° | 54.4° |
C06 | C05 | N22 | C21 | 67.5° | 69.1° |
C06 | C05 | C04 | H11 | 64.1° | 56.7° |
C06 | C05 | C04 | H12 | 175.9° | 63.2° |
C05 | C06 | H14 | H15 | 116.9° | 119.7° |
N07 | C06 | C05 | C04 | 93.5° | 170.2° |
N07 | C06 | C05 | N22 | 29.5° | 50.4° |
C06 | N07 | C08 | C19 | 177.8° | 180.0° |
C06 | N07 | C08 | C18 | 116.9° | 68.4° |
C06 | N07 | C19 | C21 | 3.4° | 1.6° |
C06 | N07 | C19 | O20 | 179.1° | 178.3° |
N07 | C06 | C05 | H13 | 152.2° | 69.5° |
N07 | C06 | H14 | H15 | 116.9° | 119.8° |
C25 | C24 | N28 | C27 | 0.7° | 0.1° |
C25 | C24 | N28 | C23 | 179.7° | 179.7° |
C25 | C24 | N28 | C29 | 178.8° | 179.8° |
C25 | C24 | C23 | N22 | 83.9° | 25.7° |
C25 | C24 | C23 | H19 | 37.1° | 94.3° |
C25 | C24 | C23 | H20 | 155.1° | 145.7° |
C04 | C05 | N22 | H13 | 122.4° | 120.2° |
C04 | C05 | N22 | C23 | 82.5° | 65.5° |
C04 | C05 | N22 | C21 | 48.0° | 171.0° |
C05 | C04 | C03 | H9 | 38.2° | 65.0° |
C05 | C04 | C03 | H10 | 80.6° | 55.0° |
C05 | C04 | H11 | H12 | 120.0° | 119.9° |
C04 | C05 | C06 | H14 | 145.5° | 69.7° |
C04 | C05 | C06 | H15 | 27.4° | 49.9° |
C05 | N22 | C23 | C24 | 63.3° | 164.5° |
C05 | N22 | C23 | C21 | 130.8° | 123.0° |
C05 | N22 | C21 | C19 | 64.8° | 50.2° |
C05 | N22 | C21 | H2 | 55.2° | 69.9° |
C05 | N22 | C21 | H3 | 175.2° | 170.3° |
N22 | C05 | C04 | H11 | 57.4° | 176.0° |
N22 | C05 | C04 | H12 | 62.6° | 56.1° |
N22 | C05 | C06 | H14 | 91.5° | 170.5° |
N22 | C05 | C06 | H15 | 150.5° | 69.9° |
C05 | N22 | C23 | H19 | 57.7° | 44.5° |
C05 | N22 | C23 | H20 | 175.8° | 75.5° |
C27 | N28 | C24 | C29 | 178.2° | 179.8° |
C27 | N28 | C24 | C23 | 179.0° | 179.8° |
C27 | N28 | C29 | C30 | 109.4° | 95.3° |
C27 | N28 | C29 | H23 | 129.7° | 144.6° |
C27 | N28 | C29 | H24 | 11.6° | 24.7° |
N07 | C08 | C18 | C12 | 179.8° | 180.0° |
C08 | N07 | C19 | C21 | 178.7° | 178.3° |
C08 | N07 | C19 | O20 | 3.0° | 1.7° |
C08 | N07 | C06 | H14 | 58.6° | 41.6° |
C08 | N07 | C06 | H15 | 59.5° | 78.0° |
N07 | C08 | C09 | H16 | 0.2° | 0.0° |
N07 | C08 | C18 | H18 | 0.2° | 0.0° |
C08 | C18 | C12 | H18 | 180.0° | 180.0° |
C08 | C18 | C12 | O13 | 179.7° | 180.0° |
C18 | C08 | N07 | C19 | 65.3° | 111.7° |
C18 | C08 | C09 | H16 | 179.6° | 180.0° |
C18 | C12 | O13 | C14 | 178.6° | 179.9° |
C18 | C12 | C11 | H17 | 179.7° | 180.0° |
C12 | O13 | C14 | F16 | 175.6° | 60.1° |
C12 | O13 | C14 | F17 | 65.3° | 59.9° |
O13 | C12 | C11 | H17 | 0.2° | 0.0° |
O13 | C12 | C18 | H18 | 0.3° | 0.0° |
O13 | C14 | F16 | F17 | 119.5° | 120.0° |
N07 | C19 | C21 | N22 | 29.1° | 17.1° |
N07 | C19 | C21 | O20 | 175.7° | 179.9° |
N07 | C19 | C21 | H2 | 90.9° | 103.0° |
N07 | C19 | C21 | H3 | 149.1° | 137.2° |
C19 | N07 | C06 | H14 | 123.6° | 138.3° |
C19 | N07 | C06 | H15 | 118.4° | 102.0° |
N28 | C24 | C23 | N22 | 96.4° | 154.0° |
C24 | N28 | C29 | C30 | 72.8° | 84.9° |
N28 | C24 | C23 | H19 | 142.6° | 86.0° |
N28 | C24 | C23 | H20 | 24.6° | 33.9° |
N28 | C24 | C25 | H21 | 179.2° | 180.0° |
C24 | N28 | C27 | H22 | 179.7° | 179.9° |
C24 | N28 | C29 | H23 | 48.2° | 35.1° |
C24 | N28 | C29 | H24 | 166.2° | 155.1° |
C23 | C24 | N28 | C29 | 0.9° | 0.1° |
C24 | C23 | N22 | H19 | 121.0° | 120.0° |
C24 | C23 | N22 | H20 | 121.0° | 120.0° |
C24 | C23 | N22 | C21 | 165.9° | 72.5° |
C24 | C23 | H19 | H20 | 116.9° | 120.0° |
C23 | C24 | C25 | H21 | 1.1° | 0.3° |
N28 | C29 | C30 | C31 | 55.0° | 88.6° |
N28 | C29 | C30 | H23 | 121.0° | 120.0° |
N28 | C29 | C30 | H24 | 121.0° | 120.0° |
N28 | C29 | C30 | C36 | 126.8° | 91.1° |
C29 | N28 | C27 | H22 | 1.5° | 0.1° |
N28 | C29 | H23 | H24 | 116.9° | 120.0° |
C32 | C31 | C30 | H25 | 180.0° | 180.0° |
C31 | C32 | C33 | H26 | 180.0° | 179.9° |
C32 | C31 | C30 | C29 | 179.9° | 180.0° |
C32 | C31 | C30 | C36 | 1.7° | 0.3° |
C31 | C32 | C33 | CL34 | 179.3° | 180.0° |
C31 | C32 | C33 | C35 | 0.6° | 0.1° |
C30 | C31 | C32 | C33 | 0.7° | 0.0° |
C31 | C30 | C29 | C36 | 178.2° | 179.7° |
C31 | C30 | C36 | C35 | 1.4° | 0.6° |
C31 | C30 | C29 | H23 | 176.0° | 31.5° |
C31 | C30 | C29 | H24 | 65.9° | 151.4° |
C30 | C31 | C32 | H26 | 179.3° | 180.0° |
C31 | C30 | C36 | H28 | 178.6° | 179.7° |
C32 | C33 | CL34 | C35 | 179.9° | 179.9° |
C32 | C33 | C35 | C36 | 0.9° | 0.2° |
C33 | C32 | C31 | H25 | 179.3° | 180.0° |
C32 | C33 | C35 | H27 | 179.1° | 180.0° |
C23 | N22 | C21 | C19 | 161.9° | 73.2° |
C23 | N22 | C21 | H2 | 78.1° | 166.7° |
C23 | N22 | C21 | H3 | 41.9° | 46.9° |
C23 | N22 | C05 | H13 | 39.8° | 174.3° |
N22 | C23 | H19 | H20 | 116.9° | 120.0° |
N22 | C21 | C19 | H2 | 120.0° | 120.1° |
N22 | C21 | C19 | H3 | 120.0° | 120.1° |
N22 | C21 | C19 | O20 | 146.6° | 162.8° |
N22 | C21 | H2 | H3 | 120.0° | 119.8° |
C21 | N22 | C05 | H13 | 170.3° | 50.8° |
C21 | N22 | C23 | H19 | 73.1° | 167.5° |
C21 | N22 | C23 | H20 | 45.0° | 47.5° |
C19 | C21 | H2 | H3 | 120.0° | 119.8° |
O20 | C19 | C21 | H2 | 93.3° | 77.1° |
O20 | C19 | C21 | H3 | 26.6° | 42.7° |
C29 | C30 | C36 | C35 | 179.7° | 179.8° |
C30 | C29 | H23 | H24 | 117.0° | 120.0° |
C29 | C30 | C31 | H25 | 0.1° | 0.1° |
C29 | C30 | C36 | H28 | 0.3° | 0.0° |
C30 | C36 | C35 | C33 | 0.2° | 0.5° |
C30 | C36 | C35 | H28 | 180.0° | 179.7° |
C36 | C30 | C29 | H23 | 5.8° | 148.9° |
C36 | C30 | C29 | H24 | 112.3° | 28.9° |
C36 | C30 | C31 | H25 | 178.3° | 179.7° |
C30 | C36 | C35 | H27 | 179.9° | 179.7° |
CL34 | C33 | C35 | C36 | 179.0° | 179.7° |
CL34 | C33 | C32 | H26 | 0.8° | 0.1° |
CL34 | C33 | C35 | H27 | 1.0° | 0.1° |
C33 | C35 | C36 | H27 | 180.0° | 179.8° |
C35 | C33 | C32 | H26 | 179.3° | 180.0° |
C33 | C35 | C36 | H28 | 179.8° | 179.8° |
H1 | C10 | C09 | H16 | 0.1° | 0.3° |
H1 | C10 | C11 | H17 | 0.2° | 0.2° |
H4 | C01 | H5 | H6 | 120.0° | 120.0° |
H4 | C01 | C02 | H7 | 59.6° | 60.0° |
H4 | C01 | C02 | H8 | 59.5° | 60.0° |
H5 | C01 | C02 | H7 | 60.5° | 60.0° |
H5 | C01 | C02 | H8 | 179.5° | 180.0° |
H6 | C01 | C02 | H7 | 179.5° | NaN° |
H6 | C01 | C02 | H8 | 60.5° | 60.0° |
H7 | C02 | C03 | H9 | 134.6° | NaN° |
H7 | C02 | C03 | H10 | 15.8° | 59.9° |
H8 | C02 | C03 | H9 | 106.3° | 60.0° |
H8 | C02 | C03 | H10 | 134.9° | 180.0° |
H9 | C03 | C04 | H11 | 158.2° | 175.0° |
H9 | C03 | C04 | H12 | 81.8° | 55.0° |
H10 | C03 | C04 | H11 | 39.4° | 65.0° |
H10 | C03 | C04 | H12 | 159.4° | 175.1° |
H11 | C04 | C05 | H13 | 179.2° | 63.7° |
H12 | C04 | C05 | H13 | 60.8° | 176.4° |
H13 | C05 | C06 | H14 | 31.2° | 50.6° |
H13 | C05 | C06 | H15 | 86.8° | 170.2° |
H25 | C31 | C32 | H26 | 0.6° | 0.0° |
H27 | C35 | C36 | H28 | 0.1° | 0.1° |