ZNA
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O43 | C42 | sing | 1.43Å | 1.43Å | |
| O41 | C40 | sing | 1.43Å | 1.45Å | |
| C42 | C40 | sing | 1.52Å | 1.55Å | |
| C42 | C09 | sing | 1.54Å | 1.57Å | |
| C40 | C11 | sing | 1.54Å | 1.53Å | |
| C07 | C06 | doub | 1.38Å | 1.39Å | Aromatic |
| C07 | N08 | sing | 1.32Å | 1.40Å | Aromatic |
| C09 | N08 | sing | 1.47Å | 1.49Å | |
| C09 | S10 | sing | 1.84Å | 1.81Å | |
| C06 | C05 | sing | 1.38Å | 1.40Å | Aromatic |
| N08 | C44 | doub | 1.32Å | 1.41Å | Aromatic |
| C11 | S10 | sing | 1.84Å | 1.82Å | |
| C11 | C12 | sing | 1.53Å | 1.53Å | |
| C05 | C04 | doub | 1.40Å | 1.41Å | Aromatic |
| C44 | C04 | sing | 1.40Å | 1.41Å | Aromatic |
| C04 | C02 | sing | 1.48Å | 1.42Å | |
| C12 | O13 | sing | 1.43Å | 1.44Å | |
| O39 | C38 | sing | 1.43Å | 1.45Å | |
| C02 | N01 | sing | 1.35Å | 1.34Å | |
| C02 | O03 | doub | 1.22Å | 1.23Å | |
| O37 | C36 | sing | 1.43Å | 1.44Å | |
| O13 | P14 | sing | 1.61Å | 1.63Å | |
| C38 | C23 | sing | 1.54Å | 1.52Å | |
| C38 | C36 | sing | 1.55Å | 1.52Å | |
| C22 | C23 | sing | 1.53Å | 1.55Å | |
| C22 | O21 | sing | 1.43Å | 1.44Å | |
| C23 | O24 | sing | 1.44Å | 1.44Å | |
| C36 | C25 | sing | 1.55Å | 1.55Å | |
| O16 | P14 | doub | 1.48Å | 1.49Å | |
| P14 | O17 | sing | 1.61Å | 1.62Å | |
| P14 | O15 | sing | 1.61Å | 1.48Å | |
| O17 | P18 | sing | 1.61Å | 1.61Å | |
| O21 | P18 | sing | 1.61Å | 1.65Å | |
| C25 | O24 | sing | 1.44Å | 1.46Å | |
| C25 | N26 | sing | 1.47Å | 1.50Å | |
| O20 | P18 | doub | 1.48Å | 1.48Å | |
| P18 | O19 | sing | 1.61Å | 1.48Å | |
| N26 | C27 | sing | 1.36Å | 1.33Å | Aromatic |
| N26 | C35 | sing | 1.37Å | 1.34Å | Aromatic |
| N34 | C35 | doub | 1.33Å | 1.35Å | Aromatic |
| N34 | C33 | sing | 1.32Å | 1.41Å | Aromatic |
| C27 | N28 | doub | 1.30Å | 1.33Å | Aromatic |
| C35 | C29 | sing | 1.41Å | 1.35Å | Aromatic |
| C33 | N32 | doub | 1.32Å | 1.41Å | Aromatic |
| N28 | C29 | sing | 1.35Å | 1.33Å | Aromatic |
| C29 | C30 | doub | 1.41Å | 1.35Å | Aromatic |
| N32 | C30 | sing | 1.33Å | 1.35Å | Aromatic |
| C30 | N31 | sing | 1.38Å | 1.33Å | |
| N01 | H1 | sing | 0.97Å | 1.00Å | |
| N01 | H2 | sing | 0.97Å | 1.00Å | |
| C44 | H3 | sing | 1.08Å | 1.08Å | |
| C05 | H4 | sing | 1.08Å | 1.08Å | |
| C06 | H5 | sing | 1.08Å | 1.08Å | |
| C07 | H6 | sing | 1.08Å | 1.08Å | |
| C09 | H7 | sing | 1.09Å | 1.10Å | |
| C42 | H8 | sing | 1.09Å | 1.10Å | |
| O43 | H9 | sing | 0.97Å | 0.95Å | |
| C40 | H10 | sing | 1.09Å | 1.10Å | |
| O41 | H11 | sing | 0.97Å | 0.95Å | |
| C11 | H12 | sing | 1.09Å | 1.10Å | |
| C12 | H13 | sing | 1.09Å | 1.10Å | |
| C12 | H14 | sing | 1.09Å | 1.10Å | |
| O15 | H15 | sing | 0.97Å | 0.95Å | |
| O19 | H16 | sing | 0.97Å | 0.95Å | |
| C22 | H17 | sing | 1.09Å | 1.10Å | |
| C22 | H18 | sing | 1.09Å | 1.10Å | |
| C23 | H19 | sing | 1.09Å | 1.10Å | |
| C38 | H20 | sing | 1.09Å | 1.10Å | |
| O39 | H21 | sing | 0.97Å | 0.95Å | |
| C36 | H22 | sing | 1.09Å | 1.10Å | |
| O37 | H23 | sing | 0.97Å | 0.95Å | |
| C25 | H24 | sing | 1.09Å | 1.10Å | |
| C27 | H25 | sing | 1.08Å | 1.08Å | |
| C33 | H26 | sing | 1.08Å | 1.08Å | |
| N31 | H27 | sing | 0.97Å | 1.00Å | |
| N31 | H28 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O43 | C42 | C40 | 107.5° | 108.9° |
| O43 | C42 | C09 | 107.7° | 108.9° |
| O43 | C42 | H8 | 111.7° | 108.7° |
| C42 | O43 | H9 | 109.5° | 114.0° |
| O41 | C40 | C42 | 110.2° | 108.9° |
| O41 | C40 | C11 | 109.5° | 108.9° |
| O41 | C40 | H10 | 111.5° | 108.7° |
| C40 | O41 | H11 | 109.5° | 114.0° |
| C40 | C42 | C09 | 110.2° | 112.6° |
| C42 | C40 | C11 | 105.3° | 112.6° |
| C40 | C42 | H8 | 109.9° | 108.9° |
| C42 | C40 | H10 | 109.9° | 108.9° |
| C42 | C09 | N08 | 121.0° | 110.8° |
| C42 | C09 | S10 | 102.3° | 102.6° |
| C42 | C09 | H7 | 110.2° | 110.9° |
| C09 | C42 | H8 | 109.7° | 108.9° |
| C40 | C11 | S10 | 100.0° | 102.6° |
| C40 | C11 | C12 | 113.1° | 110.8° |
| C11 | C40 | H10 | 110.2° | 108.9° |
| C40 | C11 | H12 | 112.0° | 110.8° |
| C06 | C07 | N08 | 119.0° | 121.1° |
| C07 | C06 | C05 | 120.9° | 119.3° |
| C07 | C06 | H5 | 119.5° | 120.3° |
| C06 | C07 | H6 | 120.5° | 119.4° |
| C07 | N08 | C09 | 123.7° | 119.0° |
| C07 | N08 | C44 | 119.8° | 121.9° |
| N08 | C07 | H6 | 120.5° | 119.5° |
| N08 | C09 | S10 | 103.0° | 110.8° |
| C09 | N08 | C44 | 116.4° | 119.1° |
| N08 | C09 | H7 | 111.4° | 110.7° |
| C09 | S10 | C11 | 98.8° | 94.8° |
| S10 | C09 | H7 | 107.4° | 110.8° |
| C06 | C05 | C04 | 121.5° | 118.3° |
| C06 | C05 | H4 | 119.3° | 120.9° |
| C05 | C06 | H5 | 119.5° | 120.4° |
| N08 | C44 | C04 | 121.8° | 120.6° |
| N08 | C44 | H3 | 119.1° | 119.7° |
| S10 | C11 | C12 | 110.8° | 110.8° |
| S10 | C11 | H12 | 108.4° | 110.8° |
| C11 | C12 | O13 | 112.7° | 109.4° |
| C12 | C11 | H12 | 112.0° | 110.9° |
| C11 | C12 | H13 | 108.7° | 109.5° |
| C11 | C12 | H14 | 108.7° | 109.5° |
| C05 | C04 | C44 | 116.9° | 118.9° |
| C05 | C04 | C02 | 119.8° | 120.6° |
| C04 | C05 | H4 | 119.3° | 120.8° |
| C44 | C04 | C02 | 123.3° | 120.6° |
| C04 | C44 | H3 | 119.1° | 119.7° |
| C04 | C02 | N01 | 119.2° | 120.0° |
| C04 | C02 | O03 | 120.2° | 120.0° |
| C12 | O13 | P14 | 123.7° | 123.0° |
| O13 | C12 | H13 | 108.7° | 109.5° |
| O13 | C12 | H14 | 108.7° | 109.5° |
| O39 | C38 | C23 | 111.9° | 110.5° |
| O39 | C38 | C36 | 111.6° | 110.5° |
| O39 | C38 | H20 | 111.7° | 110.5° |
| C38 | O39 | H21 | 109.5° | 114.0° |
| N01 | C02 | O03 | 120.6° | 120.0° |
| C02 | N01 | H1 | 120.0° | 120.0° |
| C02 | N01 | H2 | 120.0° | 120.0° |
| O37 | C36 | C38 | 110.5° | 110.9° |
| O37 | C36 | C25 | 110.2° | 110.9° |
| O37 | C36 | H22 | 111.6° | 110.8° |
| C36 | O37 | H23 | 109.5° | 114.0° |
| O13 | P14 | O16 | 111.3° | 109.5° |
| O13 | P14 | O17 | 101.3° | 109.5° |
| O13 | P14 | O15 | 107.1° | 109.5° |
| C23 | C38 | C36 | 99.8° | 104.2° |
| C38 | C23 | C22 | 111.6° | 109.9° |
| C38 | C23 | O24 | 102.3° | 107.3° |
| C38 | C23 | H19 | 108.8° | 110.0° |
| C23 | C38 | H20 | 110.6° | 110.5° |
| C38 | C36 | C25 | 103.6° | 102.1° |
| C36 | C38 | H20 | 110.6° | 110.4° |
| C38 | C36 | H22 | 110.5° | 110.9° |
| C23 | C22 | O21 | 112.5° | 109.5° |
| C22 | C23 | O24 | 115.5° | 109.9° |
| C23 | C22 | H17 | 108.7° | 109.4° |
| C23 | C22 | H18 | 108.7° | 109.5° |
| C22 | C23 | H19 | 108.5° | 109.9° |
| C22 | O21 | P18 | 123.9° | 123.0° |
| O21 | C22 | H17 | 108.7° | 109.5° |
| O21 | C22 | H18 | 108.7° | 109.5° |
| C23 | O24 | C25 | 105.2° | 107.0° |
| O24 | C23 | H19 | 109.8° | 109.9° |
| C36 | C25 | O24 | 105.8° | 103.5° |
| C36 | C25 | N26 | 111.7° | 110.6° |
| C25 | C36 | H22 | 110.2° | 110.9° |
| C36 | C25 | H24 | 109.0° | 110.5° |
| O16 | P14 | O17 | 106.5° | 109.5° |
| O16 | P14 | O15 | 119.3° | 109.5° |
| O17 | P14 | O15 | 109.9° | 109.5° |
| P14 | O17 | P18 | 126.2° | 134.0° |
| P14 | O15 | H15 | 109.5° | 114.0° |
| O17 | P18 | O21 | 104.9° | 109.4° |
| O17 | P18 | O20 | 106.6° | 109.5° |
| O17 | P18 | O19 | 109.1° | 109.4° |
| O21 | P18 | O20 | 109.6° | 109.5° |
| O21 | P18 | O19 | 106.9° | 109.5° |
| O24 | C25 | N26 | 110.6° | 110.6° |
| O24 | C25 | H24 | 110.1° | 110.6° |
| C25 | N26 | C27 | 123.5° | 126.3° |
| C25 | N26 | C35 | 128.7° | 126.2° |
| N26 | C25 | H24 | 109.6° | 110.7° |
| O20 | P18 | O19 | 118.9° | 109.5° |
| P18 | O19 | H16 | 109.5° | 114.0° |
| C27 | N26 | C35 | 107.8° | 107.5° |
| N26 | C27 | N28 | 108.4° | 110.0° |
| N26 | C27 | H25 | 125.8° | 125.0° |
| N26 | C35 | N34 | 131.7° | 134.9° |
| N26 | C35 | C29 | 107.9° | 105.9° |
| C35 | N34 | C33 | 119.8° | 120.7° |
| N34 | C35 | C29 | 120.4° | 119.1° |
| N34 | C33 | N32 | 118.4° | 122.4° |
| N34 | C33 | H26 | 120.8° | 118.8° |
| C27 | N28 | C29 | 108.5° | 109.5° |
| N28 | C27 | H25 | 125.8° | 125.0° |
| C35 | C29 | N28 | 107.4° | 107.2° |
| C35 | C29 | C30 | 121.0° | 118.1° |
| C33 | N32 | C30 | 118.7° | 121.2° |
| N32 | C33 | H26 | 120.8° | 118.8° |
| N28 | C29 | C30 | 131.6° | 134.7° |
| C29 | C30 | N32 | 121.8° | 118.5° |
| C29 | C30 | N31 | 116.9° | 120.8° |
| N32 | C30 | N31 | 121.3° | 120.8° |
| C30 | N31 | H27 | 109.5° | 119.9° |
| C30 | N31 | H28 | 109.5° | 120.1° |
| H1 | N01 | H2 | 120.0° | 120.1° |
| H13 | C12 | H14 | 109.4° | 109.5° |
| H17 | C22 | H18 | 109.5° | 109.4° |
| H27 | N31 | H28 | 109.5° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O43 | C42 | C40 | O41 | 47.8° | 0.0° |
| O43 | C42 | C40 | C09 | 117.1° | 120.9° |
| O43 | C42 | C40 | H8 | 121.8° | 118.3° |
| O43 | C42 | C09 | H8 | 121.8° | 118.4° |
| O43 | C42 | C40 | C11 | 70.2° | 120.8° |
| O43 | C42 | C09 | N08 | 149.8° | 96.4° |
| O43 | C42 | C09 | S10 | 96.6° | 145.3° |
| O43 | C42 | C09 | H7 | 17.4° | 27.0° |
| O43 | C42 | C40 | H10 | 171.0° | 118.3° |
| O41 | C40 | C42 | C11 | 118.0° | 120.8° |
| O41 | C40 | C42 | H10 | 123.3° | 118.4° |
| O41 | C40 | C42 | C09 | 164.9° | 120.8° |
| O41 | C40 | C11 | H10 | 123.0° | 118.4° |
| O41 | C40 | C11 | S10 | 166.6° | 145.3° |
| O41 | C40 | C11 | C12 | 75.6° | 96.4° |
| O41 | C40 | C42 | H8 | 74.0° | 118.3° |
| O41 | C40 | C11 | H12 | 52.0° | 27.1° |
| C40 | C42 | C09 | H8 | 121.2° | 120.8° |
| C42 | C40 | C11 | H10 | 118.5° | 120.8° |
| C40 | C42 | C09 | N08 | 93.2° | 142.8° |
| C40 | C42 | C09 | S10 | 20.3° | 24.5° |
| C42 | C40 | C11 | S10 | 48.1° | 24.5° |
| C42 | C40 | C11 | C12 | 165.9° | 142.8° |
| C40 | C42 | C09 | H7 | 134.4° | 93.9° |
| C40 | C42 | O43 | H9 | 180.0° | 61.5° |
| C42 | C40 | O41 | H11 | 180.0° | 61.5° |
| C42 | C40 | C11 | H12 | 66.5° | 93.7° |
| C09 | C42 | C40 | C11 | 46.9° | 0.0° |
| C42 | C09 | N08 | C07 | 16.4° | 54.6° |
| C42 | C09 | N08 | S10 | 113.2° | 113.2° |
| C42 | C09 | N08 | H7 | 131.9° | 123.5° |
| C42 | C09 | S10 | H7 | 116.1° | 118.4° |
| C42 | C09 | N08 | C44 | 166.0° | 125.6° |
| C42 | C09 | S10 | C11 | 8.0° | 34.5° |
| C09 | C42 | O43 | H9 | 61.3° | 175.4° |
| C09 | C42 | C40 | H10 | 71.9° | 120.8° |
| C40 | C11 | S10 | C09 | 33.3° | 34.5° |
| C40 | C11 | S10 | C12 | 119.5° | 118.3° |
| C40 | C11 | S10 | H12 | 117.3° | 118.2° |
| C40 | C11 | C12 | H12 | 127.6° | 123.4° |
| C40 | C11 | C12 | O13 | 108.6° | 55.0° |
| C11 | C40 | C42 | H8 | 168.0° | 120.8° |
| C11 | C40 | O41 | H11 | 64.7° | 175.4° |
| C40 | C11 | C12 | H13 | 130.8° | 175.0° |
| C40 | C11 | C12 | H14 | 11.9° | 65.0° |
| C06 | C07 | N08 | H6 | 180.0° | 179.7° |
| C06 | C07 | N08 | C09 | 178.9° | 180.0° |
| C07 | C06 | C05 | H5 | 180.0° | 179.9° |
| C06 | C07 | N08 | C44 | 1.4° | 0.3° |
| C07 | C06 | C05 | C04 | 0.5° | 0.0° |
| C07 | C06 | C05 | H4 | 179.5° | 180.0° |
| C07 | N08 | C09 | C44 | 177.6° | 179.7° |
| C07 | N08 | C09 | S10 | 96.7° | 58.5° |
| N08 | C07 | C06 | C05 | 0.3° | 0.2° |
| C07 | N08 | C44 | C04 | 1.8° | 0.0° |
| C07 | N08 | C44 | H3 | 178.2° | 179.9° |
| N08 | C07 | C06 | H5 | 179.7° | 179.7° |
| C07 | N08 | C09 | H7 | 148.4° | 178.1° |
| N08 | C09 | S10 | H7 | 117.7° | 123.3° |
| N08 | C09 | S10 | C11 | 134.2° | 152.8° |
| C09 | N08 | C44 | C04 | 179.4° | 179.7° |
| C09 | N08 | C44 | H3 | 0.6° | 0.3° |
| C09 | N08 | C07 | H6 | 1.1° | 0.3° |
| N08 | C09 | C42 | H8 | 28.0° | 22.0° |
| S10 | C09 | N08 | C44 | 80.8° | 121.2° |
| C09 | S10 | C11 | C12 | 152.8° | 152.8° |
| S10 | C09 | C42 | H8 | 141.6° | 96.3° |
| C09 | S10 | C11 | H12 | 84.0° | 83.7° |
| C06 | C05 | C04 | H4 | 180.0° | 180.0° |
| C06 | C05 | C04 | C44 | 0.2° | 0.3° |
| C06 | C05 | C04 | C02 | 179.2° | 180.0° |
| C05 | C06 | C07 | H6 | 179.7° | 179.9° |
| N08 | C44 | C04 | C05 | 1.0° | 0.3° |
| N08 | C44 | C04 | H3 | 180.0° | 179.9° |
| N08 | C44 | C04 | C02 | 179.7° | 180.0° |
| C44 | N08 | C07 | H6 | 178.6° | 180.0° |
| C44 | N08 | C09 | H7 | 34.1° | 2.2° |
| S10 | C11 | C12 | H12 | 121.1° | 123.4° |
| S10 | C11 | C12 | O13 | 2.6° | 58.2° |
| C11 | S10 | C09 | H7 | 108.1° | 83.9° |
| S10 | C11 | C40 | H10 | 70.4° | 96.3° |
| S10 | C11 | C12 | H13 | 117.9° | 61.8° |
| S10 | C11 | C12 | H14 | 123.1° | 178.1° |
| C11 | C12 | O13 | H13 | 120.5° | 120.0° |
| C11 | C12 | O13 | H14 | 120.5° | 120.0° |
| C11 | C12 | O13 | P14 | 102.1° | 180.0° |
| C12 | C11 | C40 | H10 | 47.4° | 22.0° |
| C11 | C12 | H13 | H14 | 118.5° | 120.0° |
| C05 | C04 | C44 | C02 | 179.3° | 179.8° |
| C05 | C04 | C02 | N01 | 163.0° | 0.3° |
| C05 | C04 | C02 | O03 | 18.1° | 179.7° |
| C05 | C04 | C44 | H3 | 179.0° | 179.7° |
| C04 | C05 | C06 | H5 | 179.5° | 180.0° |
| C44 | C04 | C02 | N01 | 17.7° | 180.0° |
| C44 | C04 | C02 | O03 | 161.3° | 0.1° |
| C44 | C04 | C05 | H4 | 179.8° | 179.7° |
| C04 | C02 | N01 | O03 | 178.9° | 179.9° |
| C04 | C02 | N01 | H1 | 178.9° | 180.0° |
| C04 | C02 | N01 | H2 | 1.1° | 0.3° |
| C02 | C04 | C44 | H3 | 0.3° | 0.1° |
| C02 | C04 | C05 | H4 | 0.8° | 0.0° |
| C12 | O13 | P14 | O16 | 1.6° | 55.0° |
| C12 | O13 | P14 | O17 | 114.4° | 175.0° |
| C12 | O13 | P14 | O15 | 130.4° | 65.0° |
| O13 | C12 | C11 | H12 | 123.7° | 178.4° |
| O13 | C12 | H13 | H14 | 118.5° | 120.0° |
| O39 | C38 | C36 | O37 | 33.9° | 20.4° |
| O39 | C38 | C23 | C36 | 118.2° | 118.7° |
| O39 | C38 | C23 | H20 | 125.3° | 122.7° |
| O39 | C38 | C36 | H20 | 125.1° | 122.6° |
| O39 | C38 | C23 | C22 | 69.9° | 119.9° |
| O39 | C38 | C23 | O24 | 166.0° | 120.7° |
| O39 | C38 | C36 | C25 | 151.9° | 97.9° |
| O39 | C38 | C23 | H19 | 49.8° | 1.2° |
| O39 | C38 | C36 | H22 | 90.1° | 144.0° |
| C02 | N01 | H1 | H2 | 180.0° | 179.7° |
| O03 | C02 | N01 | H1 | 0.0° | 0.0° |
| O03 | C02 | N01 | H2 | 180.0° | 179.8° |
| O37 | C36 | C38 | C23 | 84.5° | 139.0° |
| O37 | C36 | C38 | C25 | 118.0° | 118.2° |
| O37 | C36 | C38 | H22 | 124.1° | 123.7° |
| O37 | C36 | C25 | H22 | 123.6° | 123.6° |
| O37 | C36 | C25 | O24 | 109.5° | 155.2° |
| O37 | C36 | C25 | N26 | 130.2° | 86.3° |
| O37 | C36 | C38 | H20 | 159.0° | 102.2° |
| O37 | C36 | C25 | H24 | 8.9° | 36.7° |
| O13 | P14 | O16 | O17 | 109.5° | 120.0° |
| O13 | P14 | O16 | O15 | 125.5° | 120.0° |
| O13 | P14 | O17 | O15 | 113.0° | 120.0° |
| O13 | P14 | O17 | P18 | 95.7° | 165.0° |
| P14 | O13 | C12 | H13 | 18.4° | 60.0° |
| P14 | O13 | C12 | H14 | 137.4° | 60.0° |
| O13 | P14 | O15 | H15 | 127.5° | 60.1° |
| C23 | C38 | C36 | H20 | 116.5° | 118.7° |
| C38 | C23 | C22 | O24 | 116.3° | 117.8° |
| C38 | C23 | C22 | H19 | 119.9° | 121.2° |
| C38 | C23 | C22 | O21 | 72.1° | 175.7° |
| C38 | C23 | O24 | H19 | 115.5° | 119.6° |
| C23 | C38 | C36 | C25 | 33.5° | 20.8° |
| C38 | C23 | O24 | C25 | 43.7° | 26.5° |
| C38 | C23 | C22 | H17 | 167.4° | 64.3° |
| C38 | C23 | C22 | H18 | 48.3° | 55.7° |
| C23 | C38 | O39 | H21 | 180.0° | 180.0° |
| C23 | C38 | C36 | H22 | 151.5° | 97.3° |
| C36 | C38 | C23 | C22 | 171.9° | 121.5° |
| C36 | C38 | C23 | O24 | 47.8° | 2.1° |
| C38 | C36 | C25 | H22 | 118.2° | 118.2° |
| C38 | C36 | C25 | O24 | 8.7° | 37.0° |
| C38 | C36 | C25 | N26 | 111.6° | 155.5° |
| C36 | C38 | C23 | H19 | 68.4° | 117.4° |
| C36 | C38 | O39 | H21 | 69.2° | 65.2° |
| C38 | C36 | O37 | H23 | 180.0° | 61.5° |
| C38 | C36 | C25 | H24 | 127.1° | 81.5° |
| C23 | C22 | O21 | H17 | 120.5° | 120.0° |
| C23 | C22 | O21 | H18 | 120.5° | 120.0° |
| C22 | C23 | O24 | H19 | 123.0° | 121.0° |
| C23 | C22 | O21 | P18 | 136.3° | 180.0° |
| C22 | C23 | O24 | C25 | 165.2° | 146.0° |
| C23 | C22 | H17 | H18 | 118.6° | 120.0° |
| C22 | C23 | C38 | H20 | 55.4° | 2.8° |
| O21 | C22 | C23 | O24 | 44.2° | 66.4° |
| C22 | O21 | P18 | O17 | 86.6° | 175.0° |
| C22 | O21 | P18 | O20 | 27.4° | 55.0° |
| C22 | O21 | P18 | O19 | 157.6° | 65.0° |
| O21 | C22 | H17 | H18 | 118.6° | 120.0° |
| O21 | C22 | C23 | H19 | 167.9° | 54.6° |
| C23 | O24 | C25 | C36 | 21.6° | 40.0° |
| C23 | O24 | C25 | N26 | 142.7° | 158.5° |
| O24 | C23 | C22 | H17 | 76.2° | 53.6° |
| O24 | C23 | C22 | H18 | 164.7° | 173.5° |
| O24 | C23 | C38 | H20 | 68.7° | 116.6° |
| C23 | O24 | C25 | H24 | 96.1° | 78.4° |
| C36 | C25 | O24 | N26 | 121.1° | 118.5° |
| C36 | C25 | O24 | H24 | 117.7° | 118.4° |
| C36 | C25 | N26 | H24 | 120.9° | 122.9° |
| C36 | C25 | N26 | C27 | 74.7° | 95.0° |
| C36 | C25 | N26 | C35 | 105.4° | 84.7° |
| C25 | C36 | C38 | H20 | 83.0° | 139.6° |
| C25 | C36 | O37 | H23 | 66.1° | 174.2° |
| O16 | P14 | O17 | O15 | 130.5° | 120.0° |
| O16 | P14 | O17 | P18 | 147.8° | 45.0° |
| O16 | P14 | O15 | H15 | 0.0° | 180.0° |
| P14 | O17 | P18 | O21 | 63.9° | 160.0° |
| P14 | O17 | P18 | O20 | 180.0° | 40.0° |
| P14 | O17 | P18 | O19 | 50.4° | 80.0° |
| O17 | P14 | O15 | H15 | 123.3° | 60.0° |
| O15 | P14 | O17 | P18 | 17.3° | 75.0° |
| O17 | P18 | O21 | O20 | 114.0° | 120.0° |
| O17 | P18 | O21 | O19 | 115.8° | 119.9° |
| O17 | P18 | O20 | O19 | 123.7° | 120.0° |
| O17 | P18 | O19 | H16 | 122.4° | 60.1° |
| O21 | P18 | O20 | O19 | 123.4° | 120.1° |
| O21 | P18 | O19 | H16 | 124.7° | 59.9° |
| P18 | O21 | C22 | H17 | 15.8° | 60.0° |
| P18 | O21 | C22 | H18 | 103.3° | 60.0° |
| O24 | C25 | N26 | H24 | 121.6° | 123.0° |
| O24 | C25 | N26 | C27 | 42.8° | 19.0° |
| O24 | C25 | N26 | C35 | 137.1° | 161.2° |
| C25 | O24 | C23 | H19 | 71.8° | 93.0° |
| O24 | C25 | C36 | H22 | 126.9° | 81.2° |
| C25 | N26 | C27 | C35 | 180.0° | 179.8° |
| C25 | N26 | C35 | N34 | 0.1° | 0.0° |
| C25 | N26 | C27 | N28 | 180.0° | 180.0° |
| C25 | N26 | C35 | C29 | 179.9° | 179.9° |
| N26 | C25 | C36 | H22 | 6.6° | 37.3° |
| C25 | N26 | C27 | H25 | 0.1° | 0.1° |
| O20 | P18 | O19 | H16 | 0.0° | 179.9° |
| C27 | N26 | C35 | N34 | 180.0° | 179.8° |
| N26 | C27 | N28 | H25 | 180.0° | 179.9° |
| C27 | N26 | C35 | C29 | 0.1° | 0.4° |
| N26 | C27 | N28 | C29 | 0.0° | 0.1° |
| C27 | N26 | C25 | H24 | 164.4° | 142.1° |
| N26 | C35 | N34 | C29 | 179.9° | 179.9° |
| N26 | C35 | N34 | C33 | 179.9° | 179.9° |
| C35 | N26 | C27 | N28 | 0.1° | 0.2° |
| N26 | C35 | C29 | N28 | 0.1° | 0.4° |
| N26 | C35 | C29 | C30 | 180.0° | 179.8° |
| C35 | N26 | C25 | H24 | 15.5° | 38.2° |
| C35 | N26 | C27 | H25 | 179.9° | 179.7° |
| C35 | N34 | C33 | N32 | 0.1° | 0.1° |
| N34 | C35 | C29 | N28 | 180.0° | 179.7° |
| N34 | C35 | C29 | C30 | 0.1° | 0.1° |
| C35 | N34 | C33 | H26 | 179.9° | 180.0° |
| C33 | N34 | C35 | C29 | 0.1° | 0.1° |
| N34 | C33 | N32 | H26 | 180.0° | 179.9° |
| N34 | C33 | N32 | C30 | 0.1° | 0.5° |
| C27 | N28 | C29 | C35 | 0.0° | 0.3° |
| C27 | N28 | C29 | C30 | 180.0° | 180.0° |
| C35 | C29 | N28 | C30 | 180.0° | 179.7° |
| C35 | C29 | C30 | N32 | 0.1° | 0.4° |
| C35 | C29 | C30 | N31 | 180.0° | 179.8° |
| C33 | N32 | C30 | C29 | 0.1° | 0.6° |
| C33 | N32 | C30 | N31 | 180.0° | 180.0° |
| N28 | C29 | C30 | N32 | 180.0° | 179.3° |
| N28 | C29 | C30 | N31 | 0.1° | 0.0° |
| C29 | N28 | C27 | H25 | 180.0° | 180.0° |
| C29 | C30 | N32 | N31 | 179.9° | 179.3° |
| C29 | C30 | N31 | H27 | 179.9° | 0.0° |
| C29 | C30 | N31 | H28 | 60.1° | 180.0° |
| C30 | N32 | C33 | H26 | 179.9° | 179.6° |
| N32 | C30 | N31 | H27 | 0.0° | 179.3° |
| N32 | C30 | N31 | H28 | 120.0° | 0.7° |
| C30 | N31 | H27 | H28 | 120.0° | 180.0° |
| H4 | C05 | C06 | H5 | 0.5° | 0.0° |
| H5 | C06 | C07 | H6 | 0.3° | 0.0° |
| H7 | C09 | C42 | H8 | 104.4° | 145.3° |
| H8 | C42 | O43 | H9 | 59.3° | 56.9° |
| H8 | C42 | C40 | H10 | 49.2° | 0.0° |
| H10 | C40 | O41 | H11 | 57.6° | 57.0° |
| H10 | C40 | C11 | H12 | 175.0° | 145.5° |
| H12 | C11 | C12 | H13 | 3.2° | 61.6° |
| H12 | C11 | C12 | H14 | 115.8° | 58.5° |
| H17 | C22 | C23 | H19 | 47.5° | 174.5° |
| H18 | C22 | C23 | H19 | 71.6° | 65.5° |
| H19 | C23 | C38 | H20 | 175.1° | 123.9° |
| H20 | C38 | O39 | H21 | 55.3° | 57.3° |
| H20 | C38 | C36 | H22 | 35.0° | 21.4° |
| H22 | C36 | O37 | H23 | 56.6° | 62.2° |
| H22 | C36 | C25 | H24 | 114.7° | 160.3° |
