BXN
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C01 | C02 | sing | 1.51Å | 1.53Å | |
| N03 | C02 | doub | 1.31Å | 1.36Å | Aromatic |
| N03 | N04 | sing | 1.40Å | 1.38Å | Aromatic |
| C02 | C08 | sing | 1.40Å | 1.42Å | Aromatic |
| N04 | C05 | sing | 1.46Å | 1.44Å | |
| N04 | C06 | sing | 1.36Å | 1.40Å | Aromatic |
| C08 | C06 | doub | 1.36Å | 1.39Å | Aromatic |
| C08 | N09 | sing | 1.41Å | 1.47Å | |
| C10 | N09 | sing | 1.46Å | 1.47Å | |
| C06 | C07 | sing | 1.51Å | 1.55Å | |
| N09 | S11 | sing | 1.66Å | 1.75Å | |
| O12 | S11 | doub | 1.42Å | 1.48Å | |
| S11 | O13 | doub | 1.42Å | 1.48Å | |
| S11 | C14 | sing | 1.76Å | 1.85Å | |
| CL2 | C32 | sing | 1.74Å | 1.78Å | |
| C14 | C32 | doub | 1.38Å | 1.41Å | Aromatic |
| C14 | C15 | sing | 1.38Å | 1.40Å | Aromatic |
| CL1 | C15 | sing | 1.74Å | 1.79Å | |
| C32 | C31 | sing | 1.38Å | 1.40Å | Aromatic |
| C15 | C17 | doub | 1.38Å | 1.39Å | Aromatic |
| C31 | C18 | doub | 1.38Å | 1.39Å | Aromatic |
| C17 | C18 | sing | 1.38Å | 1.40Å | Aromatic |
| C18 | C19 | sing | 1.51Å | 1.56Å | |
| C29 | C30 | sing | 1.53Å | 1.56Å | |
| C29 | C28 | sing | 1.55Å | 1.47Å | |
| C29 | N25 | sing | 1.48Å | 1.46Å | |
| C21 | N22 | sing | 1.47Å | 1.48Å | |
| C21 | C20 | sing | 1.53Å | 1.56Å | |
| C30 | N22 | sing | 1.47Å | 1.45Å | |
| C28 | C27 | sing | 1.54Å | 1.46Å | |
| N22 | C23 | sing | 1.47Å | 1.44Å | |
| N25 | C24 | sing | 1.45Å | 1.44Å | |
| N25 | C26 | sing | 1.48Å | 1.52Å | |
| C24 | C23 | sing | 1.53Å | 1.54Å | |
| C19 | C20 | sing | 1.53Å | 1.55Å | |
| C27 | C26 | sing | 1.55Å | 1.58Å | |
| C10 | H1 | sing | 1.09Å | 1.10Å | |
| C10 | H2 | sing | 1.09Å | 1.10Å | |
| C10 | H3 | sing | 1.09Å | 1.10Å | |
| C17 | H4 | sing | 1.08Å | 1.08Å | |
| C20 | H5 | sing | 1.09Å | 1.10Å | |
| C20 | H6 | sing | 1.09Å | 1.10Å | |
| C21 | H7 | sing | 1.09Å | 1.10Å | |
| C21 | H8 | sing | 1.09Å | 1.10Å | |
| C24 | H9 | sing | 1.09Å | 1.10Å | |
| C24 | H10 | sing | 1.09Å | 1.10Å | |
| C26 | H11 | sing | 1.09Å | 1.10Å | |
| C26 | H12 | sing | 1.09Å | 1.10Å | |
| C28 | H13 | sing | 1.09Å | 1.10Å | |
| C28 | H14 | sing | 1.09Å | 1.10Å | |
| C01 | H15 | sing | 1.09Å | 1.10Å | |
| C01 | H16 | sing | 1.09Å | 1.10Å | |
| C01 | H17 | sing | 1.09Å | 1.10Å | |
| C05 | H18 | sing | 1.09Å | 1.10Å | |
| C05 | H19 | sing | 1.09Å | 1.10Å | |
| C05 | H20 | sing | 1.09Å | 1.10Å | |
| C07 | H21 | sing | 1.09Å | 1.10Å | |
| C07 | H22 | sing | 1.09Å | 1.10Å | |
| C07 | H23 | sing | 1.09Å | 1.10Å | |
| C19 | H24 | sing | 1.09Å | 1.10Å | |
| C19 | H25 | sing | 1.09Å | 1.10Å | |
| C23 | H26 | sing | 1.09Å | 1.10Å | |
| C23 | H27 | sing | 1.09Å | 1.10Å | |
| C27 | H28 | sing | 1.09Å | 1.10Å | |
| C27 | H29 | sing | 1.09Å | 1.10Å | |
| C29 | H30 | sing | 1.09Å | 1.10Å | |
| C30 | H31 | sing | 1.09Å | 1.10Å | |
| C30 | H32 | sing | 1.09Å | 1.10Å | |
| C31 | H33 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C01 | C02 | N03 | 123.7° | 125.8° |
| C01 | C02 | C08 | 128.6° | 125.8° |
| C02 | C01 | H15 | 109.5° | 109.4° |
| C02 | C01 | H16 | 109.5° | 109.5° |
| C02 | C01 | H17 | 109.5° | 109.5° |
| C02 | N03 | N04 | 108.7° | 108.4° |
| N03 | C02 | C08 | 107.7° | 108.4° |
| N03 | N04 | C05 | 123.3° | 126.1° |
| N03 | N04 | C06 | 108.9° | 107.8° |
| C02 | C08 | C06 | 107.8° | 107.9° |
| C02 | C08 | N09 | 124.8° | 126.1° |
| C05 | N04 | C06 | 127.8° | 126.1° |
| N04 | C05 | H18 | 109.5° | 109.5° |
| N04 | C05 | H19 | 109.5° | 109.4° |
| N04 | C05 | H20 | 109.5° | 109.5° |
| N04 | C06 | C08 | 106.8° | 107.6° |
| N04 | C06 | C07 | 121.4° | 126.2° |
| C06 | C08 | N09 | 127.4° | 126.1° |
| C08 | C06 | C07 | 131.8° | 126.2° |
| C08 | N09 | C10 | 119.6° | 120.0° |
| C08 | N09 | S11 | 117.8° | 120.0° |
| C10 | N09 | S11 | 122.7° | 120.0° |
| N09 | C10 | H1 | 109.5° | 109.5° |
| N09 | C10 | H2 | 109.5° | 109.5° |
| N09 | C10 | H3 | 109.5° | 109.4° |
| C06 | C07 | H21 | 109.5° | 109.5° |
| C06 | C07 | H22 | 109.5° | 109.5° |
| C06 | C07 | H23 | 109.4° | 109.5° |
| N09 | S11 | O12 | 112.5° | 106.4° |
| N09 | S11 | O13 | 110.2° | 106.4° |
| N09 | S11 | C14 | 104.6° | 107.2° |
| O12 | S11 | O13 | 104.3° | 123.2° |
| O12 | S11 | C14 | 113.0° | 106.4° |
| O13 | S11 | C14 | 112.4° | 106.4° |
| S11 | C14 | C32 | 123.8° | 120.0° |
| S11 | C14 | C15 | 118.0° | 120.0° |
| CL2 | C32 | C14 | 123.2° | 120.0° |
| CL2 | C32 | C31 | 115.1° | 120.0° |
| C32 | C14 | C15 | 118.2° | 119.9° |
| C14 | C32 | C31 | 121.7° | 120.0° |
| C14 | C15 | CL1 | 122.9° | 120.0° |
| C14 | C15 | C17 | 119.9° | 120.0° |
| CL1 | C15 | C17 | 117.2° | 120.0° |
| C32 | C31 | C18 | 119.3° | 120.0° |
| C32 | C31 | H33 | 120.4° | 120.0° |
| C15 | C17 | C18 | 121.6° | 120.0° |
| C15 | C17 | H4 | 119.3° | 120.0° |
| C31 | C18 | C17 | 119.4° | 120.1° |
| C31 | C18 | C19 | 123.3° | 120.0° |
| C18 | C31 | H33 | 120.4° | 120.0° |
| C17 | C18 | C19 | 117.3° | 120.0° |
| C18 | C17 | H4 | 119.2° | 120.0° |
| C18 | C19 | C20 | 113.9° | 109.5° |
| C18 | C19 | H24 | 108.3° | 109.5° |
| C18 | C19 | H25 | 108.3° | 109.5° |
| C30 | C29 | C28 | 108.0° | 107.3° |
| C30 | C29 | N25 | 112.8° | 110.2° |
| C29 | C30 | N22 | 109.3° | 110.4° |
| C30 | C29 | H30 | 109.4° | 111.4° |
| C29 | C30 | H31 | 109.5° | 109.3° |
| C29 | C30 | H32 | 109.5° | 109.3° |
| C28 | C29 | N25 | 105.3° | 103.7° |
| C29 | C28 | C27 | 107.7° | 104.9° |
| C29 | C28 | H13 | 109.9° | 110.3° |
| C29 | C28 | H14 | 109.9° | 110.4° |
| C28 | C29 | H30 | 110.6° | 111.6° |
| C29 | N25 | C24 | 117.1° | 114.0° |
| C29 | N25 | C26 | 106.2° | 105.0° |
| N25 | C29 | H30 | 110.8° | 112.3° |
| N22 | C21 | C20 | 108.9° | 109.5° |
| C21 | N22 | C30 | 116.0° | 111.0° |
| C21 | N22 | C23 | 115.3° | 111.0° |
| N22 | C21 | H7 | 109.6° | 109.5° |
| N22 | C21 | H8 | 109.6° | 109.4° |
| C21 | C20 | C19 | 110.0° | 109.5° |
| C21 | C20 | H5 | 109.4° | 109.4° |
| C21 | C20 | H6 | 109.3° | 109.5° |
| C20 | C21 | H7 | 109.6° | 109.5° |
| C20 | C21 | H8 | 109.6° | 109.5° |
| C30 | N22 | C23 | 118.8° | 110.1° |
| N22 | C30 | H31 | 109.5° | 109.3° |
| N22 | C30 | H32 | 109.5° | 109.3° |
| C28 | C27 | C26 | 106.9° | 105.1° |
| C27 | C28 | H13 | 109.9° | 110.3° |
| C27 | C28 | H14 | 109.9° | 110.4° |
| C28 | C27 | H28 | 110.1° | 110.3° |
| C28 | C27 | H29 | 110.1° | 110.3° |
| N22 | C23 | C24 | 111.0° | 108.4° |
| N22 | C23 | H26 | 109.1° | 109.7° |
| N22 | C23 | H27 | 109.1° | 109.9° |
| C24 | N25 | C26 | 111.8° | 113.4° |
| N25 | C24 | C23 | 115.9° | 110.9° |
| N25 | C24 | H9 | 107.8° | 109.2° |
| N25 | C24 | H10 | 107.8° | 109.1° |
| N25 | C26 | C27 | 101.5° | 104.1° |
| N25 | C26 | H11 | 111.4° | 110.6° |
| N25 | C26 | H12 | 111.4° | 110.5° |
| C23 | C24 | H9 | 107.8° | 109.2° |
| C23 | C24 | H10 | 107.8° | 109.2° |
| C24 | C23 | H26 | 109.1° | 109.6° |
| C24 | C23 | H27 | 109.1° | 109.6° |
| C19 | C20 | H5 | 109.3° | 109.5° |
| C19 | C20 | H6 | 109.3° | 109.5° |
| C20 | C19 | H24 | 108.3° | 109.5° |
| C20 | C19 | H25 | 108.3° | 109.4° |
| C27 | C26 | H11 | 111.4° | 110.5° |
| C27 | C26 | H12 | 111.4° | 110.6° |
| C26 | C27 | H28 | 110.1° | 110.3° |
| C26 | C27 | H29 | 110.1° | 110.3° |
| H1 | C10 | H2 | 109.4° | 109.4° |
| H1 | C10 | H3 | 109.5° | 109.5° |
| H2 | C10 | H3 | 109.5° | 109.5° |
| H5 | C20 | H6 | 109.5° | 109.4° |
| H7 | C21 | H8 | 109.4° | 109.4° |
| H9 | C24 | H10 | 109.5° | 109.1° |
| H11 | C26 | H12 | 109.5° | 110.4° |
| H13 | C28 | H14 | 109.5° | 110.3° |
| H15 | C01 | H16 | 109.5° | 109.5° |
| H15 | C01 | H17 | 109.5° | 109.4° |
| H16 | C01 | H17 | 109.5° | 109.5° |
| H18 | C05 | H19 | 109.5° | 109.5° |
| H18 | C05 | H20 | 109.5° | 109.5° |
| H19 | C05 | H20 | 109.4° | 109.5° |
| H21 | C07 | H22 | 109.5° | 109.4° |
| H21 | C07 | H23 | 109.5° | 109.5° |
| H22 | C07 | H23 | 109.5° | 109.5° |
| H24 | C19 | H25 | 109.5° | 109.5° |
| H26 | C23 | H27 | 109.4° | 109.6° |
| H28 | C27 | H29 | 109.4° | 110.4° |
| H31 | C30 | H32 | 109.5° | 109.2° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C01 | C02 | N03 | C08 | 179.9° | 179.7° |
| C01 | C02 | N03 | N04 | 179.8° | 180.0° |
| C01 | C02 | C08 | C06 | 179.6° | 180.0° |
| C01 | C02 | C08 | N09 | 0.3° | 0.0° |
| C02 | C01 | H15 | H16 | 120.0° | 120.0° |
| C02 | C01 | H15 | H17 | 120.0° | 120.0° |
| C02 | C01 | H16 | H17 | 120.0° | 120.0° |
| C02 | N03 | N04 | C05 | 179.4° | 180.0° |
| C02 | N03 | N04 | C06 | 0.7° | 0.2° |
| N03 | C02 | C08 | C06 | 0.5° | 0.2° |
| N03 | C02 | C08 | N09 | 179.6° | 179.8° |
| N03 | C02 | C01 | H15 | 0.0° | 90.4° |
| N03 | C02 | C01 | H16 | 120.0° | 29.7° |
| N03 | C02 | C01 | H17 | 120.0° | 149.7° |
| N04 | N03 | C02 | C08 | 0.1° | 0.3° |
| N03 | N04 | C05 | C06 | 178.4° | 179.8° |
| N03 | N04 | C06 | C08 | 1.0° | 0.0° |
| N03 | N04 | C06 | C07 | 179.5° | 179.9° |
| N03 | N04 | C05 | H18 | 0.0° | 90.0° |
| N03 | N04 | C05 | H19 | 120.0° | 150.0° |
| N03 | N04 | C05 | H20 | 120.0° | 30.0° |
| C02 | C08 | C06 | N04 | 0.9° | 0.1° |
| C02 | C08 | C06 | N09 | 179.9° | 180.0° |
| C02 | C08 | N09 | C10 | 90.8° | 90.0° |
| C02 | C08 | C06 | C07 | 179.2° | 180.0° |
| C02 | C08 | N09 | S11 | 89.7° | 90.0° |
| C08 | C02 | C01 | H15 | 179.9° | 90.0° |
| C08 | C02 | C01 | H16 | 60.1° | 150.0° |
| C08 | C02 | C01 | H17 | 59.9° | 30.0° |
| C05 | N04 | C06 | C08 | 179.6° | 179.8° |
| C05 | N04 | C06 | C07 | 2.0° | 0.0° |
| N04 | C05 | H18 | H19 | 120.0° | 120.0° |
| N04 | C05 | H18 | H20 | 120.0° | 120.0° |
| N04 | C05 | H19 | H20 | 120.0° | 119.9° |
| N04 | C06 | C08 | C07 | 178.3° | 179.9° |
| N04 | C06 | C08 | N09 | 179.2° | 179.9° |
| C06 | N04 | C05 | H18 | 178.4° | 90.2° |
| C06 | N04 | C05 | H19 | 61.6° | 29.8° |
| C06 | N04 | C05 | H20 | 58.4° | 149.8° |
| N04 | C06 | C07 | H21 | 89.2° | 89.8° |
| N04 | C06 | C07 | H22 | 150.8° | 30.1° |
| N04 | C06 | C07 | H23 | 30.8° | 150.2° |
| C06 | C08 | N09 | C10 | 89.0° | 90.0° |
| C06 | C08 | N09 | S11 | 90.5° | 90.0° |
| C08 | C06 | C07 | H21 | 88.8° | 90.0° |
| C08 | C06 | C07 | H22 | 31.2° | 150.1° |
| C08 | C06 | C07 | H23 | 151.2° | 30.0° |
| C08 | N09 | C10 | S11 | 179.5° | 179.9° |
| N09 | C08 | C06 | C07 | 1.0° | 0.0° |
| C08 | N09 | S11 | O12 | 57.1° | 156.5° |
| C08 | N09 | S11 | O13 | 173.0° | 23.6° |
| C08 | N09 | S11 | C14 | 66.0° | 90.0° |
| C08 | N09 | C10 | H1 | 180.0° | 90.0° |
| C08 | N09 | C10 | H2 | 60.0° | 150.0° |
| C08 | N09 | C10 | H3 | 60.0° | 30.1° |
| C10 | N09 | S11 | O12 | 123.4° | 23.6° |
| C10 | N09 | S11 | O13 | 7.5° | 156.5° |
| C10 | N09 | S11 | C14 | 113.5° | 90.0° |
| N09 | C10 | H1 | H2 | 120.0° | 120.0° |
| N09 | C10 | H1 | H3 | 120.0° | 120.0° |
| N09 | C10 | H2 | H3 | 120.0° | 119.9° |
| C06 | C07 | H21 | H22 | 120.0° | 119.9° |
| C06 | C07 | H21 | H23 | 120.0° | 120.1° |
| C06 | C07 | H22 | H23 | 120.0° | 120.1° |
| N09 | S11 | O12 | O13 | 119.5° | 122.9° |
| N09 | S11 | O12 | C14 | 118.1° | 114.1° |
| N09 | S11 | O13 | C14 | 116.2° | 114.1° |
| N09 | S11 | C14 | C32 | 111.0° | 90.0° |
| N09 | S11 | C14 | C15 | 67.7° | 90.0° |
| S11 | N09 | C10 | H1 | 0.5° | 90.0° |
| S11 | N09 | C10 | H2 | 120.5° | 30.0° |
| S11 | N09 | C10 | H3 | 119.5° | 150.0° |
| O12 | S11 | O13 | C14 | 122.8° | 123.0° |
| O12 | S11 | C14 | C32 | 11.6° | 156.5° |
| O12 | S11 | C14 | C15 | 169.6° | 23.6° |
| O13 | S11 | C14 | C32 | 129.4° | 23.5° |
| O13 | S11 | C14 | C15 | 51.8° | 156.5° |
| S11 | C14 | C32 | CL2 | 0.7° | 0.0° |
| S11 | C14 | C32 | C15 | 178.8° | 179.9° |
| S11 | C14 | C15 | CL1 | 0.5° | 0.2° |
| S11 | C14 | C32 | C31 | 179.1° | 180.0° |
| S11 | C14 | C15 | C17 | 179.5° | 180.0° |
| CL2 | C32 | C14 | C31 | 179.8° | 180.0° |
| CL2 | C32 | C14 | C15 | 179.4° | 180.0° |
| CL2 | C32 | C31 | C18 | 179.8° | 179.9° |
| CL2 | C32 | C31 | H33 | 0.2° | 0.1° |
| C32 | C14 | C15 | CL1 | 179.3° | 179.7° |
| C32 | C14 | C15 | C17 | 0.7° | 0.1° |
| C14 | C32 | C31 | C18 | 0.0° | 0.1° |
| C14 | C32 | C31 | H33 | 180.0° | 179.9° |
| C14 | C15 | CL1 | C17 | 180.0° | 179.8° |
| C15 | C14 | C32 | C31 | 0.3° | 0.1° |
| C14 | C15 | C17 | C18 | 0.8° | 0.1° |
| C14 | C15 | C17 | H4 | 179.2° | 180.0° |
| CL1 | C15 | C17 | C18 | 179.2° | 179.7° |
| CL1 | C15 | C17 | H4 | 0.8° | 0.2° |
| C32 | C31 | C18 | H33 | 180.0° | 179.9° |
| C32 | C31 | C18 | C17 | 0.1° | 0.1° |
| C32 | C31 | C18 | C19 | 180.0° | 180.0° |
| C15 | C17 | C18 | C31 | 0.4° | 0.1° |
| C15 | C17 | C18 | H4 | 180.0° | 180.0° |
| C15 | C17 | C18 | C19 | 179.7° | 180.0° |
| C31 | C18 | C17 | C19 | 179.9° | 179.9° |
| C31 | C18 | C19 | C20 | 10.7° | 90.0° |
| C31 | C18 | C17 | H4 | 179.6° | 180.0° |
| C31 | C18 | C19 | H24 | 110.0° | 150.0° |
| C31 | C18 | C19 | H25 | 131.3° | 29.9° |
| C17 | C18 | C19 | C20 | 169.4° | 90.0° |
| C17 | C18 | C19 | H24 | 70.0° | 30.0° |
| C17 | C18 | C19 | H25 | 48.8° | 150.0° |
| C17 | C18 | C31 | H33 | 180.0° | 180.0° |
| C18 | C19 | C20 | C21 | 77.8° | 180.0° |
| C18 | C19 | C20 | H24 | 120.6° | 120.0° |
| C18 | C19 | C20 | H25 | 120.6° | 120.0° |
| C19 | C18 | C17 | H4 | 0.4° | 0.0° |
| C18 | C19 | C20 | H5 | 162.1° | 60.0° |
| C18 | C19 | C20 | H6 | 42.2° | 60.0° |
| C18 | C19 | H24 | H25 | 118.0° | 120.0° |
| C19 | C18 | C31 | H33 | 0.0° | 0.1° |
| C30 | C29 | C28 | N25 | 120.7° | 116.6° |
| C30 | C29 | C28 | H30 | 119.6° | 122.3° |
| C30 | C29 | N25 | H30 | 123.0° | 124.9° |
| C29 | C30 | N22 | C21 | 162.8° | 175.6° |
| C29 | C30 | N22 | H31 | 120.0° | 120.3° |
| C29 | C30 | N22 | H32 | 120.0° | 120.2° |
| C30 | C29 | C28 | C27 | 93.2° | 91.4° |
| C29 | C30 | N22 | C23 | 53.0° | 61.1° |
| C30 | C29 | N25 | C24 | 44.6° | 51.1° |
| C30 | C29 | N25 | C26 | 81.0° | 73.5° |
| C30 | C29 | C28 | H13 | 147.1° | 27.4° |
| C30 | C29 | C28 | H14 | 26.5° | 149.6° |
| C29 | C30 | H31 | H32 | 120.1° | 119.5° |
| C28 | C29 | N25 | H30 | 119.5° | 120.6° |
| C28 | C29 | C30 | N22 | 163.8° | 166.1° |
| C29 | C28 | C27 | H13 | 119.7° | 118.8° |
| C29 | C28 | C27 | H14 | 119.7° | 119.0° |
| C28 | C29 | N25 | C24 | 162.1° | 165.6° |
| C28 | C29 | N25 | C26 | 36.5° | 41.0° |
| C29 | C28 | C27 | C26 | 8.1° | 1.2° |
| C29 | C28 | H13 | H14 | 120.8° | 122.3° |
| C29 | C28 | C27 | H28 | 127.8° | 117.8° |
| C29 | C28 | C27 | H29 | 111.5° | 120.1° |
| C28 | C29 | C30 | H31 | 43.8° | 45.8° |
| C28 | C29 | C30 | H32 | 76.2° | 73.7° |
| N25 | C29 | C30 | N22 | 47.9° | 53.8° |
| N25 | C29 | C28 | C27 | 27.5° | 25.2° |
| C29 | N25 | C24 | C26 | 122.8° | 120.0° |
| C29 | N25 | C24 | C23 | 40.8° | 53.6° |
| C29 | N25 | C26 | C27 | 30.1° | 40.3° |
| C29 | N25 | C24 | H9 | 80.1° | 174.0° |
| C29 | N25 | C24 | H10 | 161.7° | 66.7° |
| C29 | N25 | C26 | H11 | 88.6° | 159.0° |
| C29 | N25 | C26 | H12 | 148.8° | 78.4° |
| N25 | C29 | C28 | H13 | 92.2° | 144.0° |
| N25 | C29 | C28 | H14 | 147.2° | 93.8° |
| N25 | C29 | C30 | H31 | 72.0° | 66.4° |
| N25 | C29 | C30 | H32 | 167.9° | 174.1° |
| N22 | C21 | C20 | H7 | 119.9° | 120.1° |
| N22 | C21 | C20 | H8 | 119.9° | 120.0° |
| C21 | N22 | C30 | C23 | 144.2° | 123.3° |
| C21 | N22 | C23 | C24 | 166.8° | 174.6° |
| N22 | C21 | C20 | C19 | 174.3° | 180.0° |
| N22 | C21 | C20 | H5 | 65.6° | 60.0° |
| N22 | C21 | C20 | H6 | 54.2° | 59.9° |
| N22 | C21 | H7 | H8 | 120.2° | 120.0° |
| C21 | N22 | C23 | H26 | 72.9° | 54.9° |
| C21 | N22 | C23 | H27 | 46.6° | 65.6° |
| C21 | N22 | C30 | H31 | 77.2° | 64.1° |
| C21 | N22 | C30 | H32 | 42.8° | 55.3° |
| C20 | C21 | N22 | C30 | 50.4° | 170.0° |
| C20 | C21 | N22 | C23 | 95.1° | 67.1° |
| C21 | C20 | C19 | H5 | 120.1° | 120.0° |
| C21 | C20 | C19 | H6 | 120.1° | 120.0° |
| C21 | C20 | H5 | H6 | 119.7° | 120.0° |
| C20 | C21 | H7 | H8 | 120.3° | 120.0° |
| C21 | C20 | C19 | H24 | 161.5° | 60.0° |
| C21 | C20 | C19 | H25 | 42.8° | 60.0° |
| C30 | N22 | C23 | C24 | 48.8° | 62.1° |
| C30 | N22 | C21 | H7 | 69.6° | 50.0° |
| C30 | N22 | C21 | H8 | 170.3° | 70.0° |
| C30 | N22 | C23 | H26 | 71.5° | 178.2° |
| C30 | N22 | C23 | H27 | 169.0° | 57.7° |
| N22 | C30 | C29 | H30 | 75.8° | 71.5° |
| N22 | C30 | H31 | H32 | 120.0° | 119.5° |
| C28 | C27 | C26 | N25 | 13.2° | 23.3° |
| C28 | C27 | C26 | H28 | 119.6° | 118.9° |
| C28 | C27 | C26 | H29 | 119.6° | 118.8° |
| C28 | C27 | C26 | H11 | 105.4° | 142.0° |
| C28 | C27 | C26 | H12 | 132.0° | 95.4° |
| C27 | C28 | H13 | H14 | 120.8° | 122.3° |
| C28 | C27 | H28 | H29 | 121.2° | 122.1° |
| C27 | C28 | C29 | H30 | 147.2° | 146.3° |
| N22 | C23 | C24 | N25 | 39.9° | 57.7° |
| N22 | C23 | C24 | H26 | 120.2° | 119.7° |
| N22 | C23 | C24 | H27 | 120.2° | 119.9° |
| C23 | N22 | C21 | H7 | 145.0° | 172.8° |
| C23 | N22 | C21 | H8 | 24.9° | 52.9° |
| N22 | C23 | C24 | H9 | 81.0° | 178.2° |
| N22 | C23 | C24 | H10 | 160.8° | 62.6° |
| N22 | C23 | H26 | H27 | 119.3° | 120.7° |
| C23 | N22 | C30 | H31 | 67.0° | 59.2° |
| C23 | N22 | C30 | H32 | 173.0° | 178.7° |
| N25 | C24 | C23 | H9 | 120.9° | 120.4° |
| N25 | C24 | C23 | H10 | 120.9° | 120.3° |
| C24 | N25 | C26 | C27 | 159.0° | 165.4° |
| N25 | C24 | H9 | H10 | 117.0° | 119.3° |
| C24 | N25 | C26 | H11 | 40.3° | 75.9° |
| C24 | N25 | C26 | H12 | 82.3° | 46.6° |
| N25 | C24 | C23 | H26 | 80.3° | 177.4° |
| N25 | C24 | C23 | H27 | 160.1° | 62.2° |
| C24 | N25 | C29 | H30 | 78.4° | 73.8° |
| C26 | N25 | C24 | C23 | 82.0° | 66.4° |
| N25 | C26 | C27 | H11 | 118.7° | 118.7° |
| N25 | C26 | C27 | H12 | 118.7° | 118.7° |
| C26 | N25 | C24 | H9 | 157.1° | 54.0° |
| C26 | N25 | C24 | H10 | 38.9° | 173.2° |
| N25 | C26 | H11 | H12 | 123.7° | 122.6° |
| N25 | C26 | C27 | H28 | 106.4° | 142.2° |
| N25 | C26 | C27 | H29 | 132.9° | 95.5° |
| C26 | N25 | C29 | H30 | 156.0° | 161.6° |
| C23 | C24 | H9 | H10 | 117.1° | 119.3° |
| C24 | C23 | H26 | H27 | 119.3° | 120.4° |
| C19 | C20 | H5 | H6 | 119.7° | 120.0° |
| C19 | C20 | C21 | H7 | 54.3° | 60.0° |
| C19 | C20 | C21 | H8 | 65.8° | 60.0° |
| C20 | C19 | H24 | H25 | 117.9° | 120.0° |
| C27 | C26 | H11 | H12 | 123.7° | 122.8° |
| C26 | C27 | C28 | H13 | 111.6° | 120.0° |
| C26 | C27 | C28 | H14 | 127.9° | 117.8° |
| C26 | C27 | H28 | H29 | 121.2° | 122.2° |
| H1 | C10 | H2 | H3 | 120.0° | 120.0° |
| H5 | C20 | C21 | H7 | 174.4° | 60.1° |
| H5 | C20 | C21 | H8 | 54.3° | 180.0° |
| H5 | C20 | C19 | H24 | 41.4° | 180.0° |
| H5 | C20 | C19 | H25 | 77.3° | 60.0° |
| H6 | C20 | C21 | H7 | 65.7° | 180.0° |
| H6 | C20 | C21 | H8 | 174.1° | 60.0° |
| H6 | C20 | C19 | H24 | 78.4° | 60.0° |
| H6 | C20 | C19 | H25 | 162.9° | 180.0° |
| H9 | C24 | C23 | H26 | 158.8° | 62.1° |
| H9 | C24 | C23 | H27 | 39.2° | 58.2° |
| H10 | C24 | C23 | H26 | 40.6° | 57.1° |
| H10 | C24 | C23 | H27 | 78.9° | 177.5° |
| H11 | C26 | C27 | H28 | 134.9° | 99.1° |
| H11 | C26 | C27 | H29 | 14.2° | 23.2° |
| H12 | C26 | C27 | H28 | 12.3° | 23.6° |
| H12 | C26 | C27 | H29 | 108.4° | 145.8° |
| H13 | C28 | C27 | H28 | 8.0° | 1.0° |
| H13 | C28 | C27 | H29 | 128.8° | 121.1° |
| H13 | C28 | C29 | H30 | 27.4° | 94.9° |
| H14 | C28 | C27 | H28 | 112.5° | 123.3° |
| H14 | C28 | C27 | H29 | 8.2° | 1.1° |
| H14 | C28 | C29 | H30 | 93.1° | 27.3° |
| H15 | C01 | H16 | H17 | 120.0° | 120.0° |
| H18 | C05 | H19 | H20 | 120.0° | 120.0° |
| H21 | C07 | H22 | H23 | 120.0° | 120.0° |
| H30 | C29 | C30 | H31 | 164.2° | 168.2° |
| H30 | C29 | C30 | H32 | 44.2° | 48.7° |
