N3G
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O13 | S12 | doub | 1.42Å | 1.39Å | |
| S12 | N11 | sing | 1.66Å | 1.62Å | |
| S12 | N15 | sing | 1.66Å | 1.60Å | |
| S12 | O14 | doub | 1.42Å | 1.42Å | |
| N11 | C09 | sing | 1.35Å | 1.41Å | |
| N15 | C16 | sing | 1.46Å | 1.45Å | |
| C09 | O10 | doub | 1.21Å | 1.20Å | |
| C09 | C08 | sing | 1.51Å | 1.55Å | |
| C17 | C16 | sing | 1.53Å | 1.50Å | |
| C17 | C18 | sing | 1.53Å | 1.51Å | |
| C08 | C07 | sing | 1.53Å | 1.62Å | |
| C18 | C19 | sing | 1.53Å | 1.51Å | |
| C19 | N20 | sing | 1.47Å | 1.49Å | |
| N28 | C27 | doub | 1.32Å | 1.34Å | Aromatic |
| N28 | C29 | sing | 1.33Å | 1.37Å | Aromatic |
| C07 | C06 | sing | 1.53Å | 1.54Å | |
| C27 | N26 | sing | 1.32Å | 1.37Å | Aromatic |
| C06 | C05 | sing | 1.53Å | 1.59Å | |
| N20 | C29 | sing | 1.37Å | 1.40Å | Aromatic |
| N20 | C21 | sing | 1.36Å | 1.42Å | Aromatic |
| C29 | C23 | doub | 1.40Å | 1.42Å | Aromatic |
| N26 | C24 | doub | 1.33Å | 1.37Å | Aromatic |
| C21 | N22 | doub | 1.30Å | 1.35Å | Aromatic |
| C23 | C24 | sing | 1.41Å | 1.46Å | Aromatic |
| C23 | N22 | sing | 1.36Å | 1.42Å | Aromatic |
| C05 | C04 | sing | 1.53Å | 1.56Å | |
| C24 | N25 | sing | 1.38Å | 1.36Å | |
| C04 | C30 | sing | 1.54Å | 1.56Å | |
| C04 | S03 | sing | 1.84Å | 1.81Å | |
| C30 | N31 | sing | 1.47Å | 1.39Å | |
| C30 | C01 | sing | 1.53Å | 1.58Å | |
| N31 | C32 | sing | 1.34Å | 1.39Å | |
| C01 | C02 | sing | 1.54Å | 1.53Å | |
| C01 | N34 | sing | 1.47Å | 1.46Å | |
| S03 | C02 | sing | 1.84Å | 1.77Å | |
| C32 | O33 | doub | 1.22Å | 1.23Å | |
| C32 | N34 | sing | 1.34Å | 1.41Å | |
| C21 | H1 | sing | 1.08Å | 1.08Å | |
| C18 | H2 | sing | 1.09Å | 1.10Å | |
| C18 | H3 | sing | 1.09Å | 1.10Å | |
| C19 | H4 | sing | 1.09Å | 1.10Å | |
| C19 | H5 | sing | 1.09Å | 1.10Å | |
| C27 | H6 | sing | 1.08Å | 1.08Å | |
| C30 | H7 | sing | 1.09Å | 1.10Å | |
| C01 | H8 | sing | 1.09Å | 1.10Å | |
| C02 | H9 | sing | 1.09Å | 1.10Å | |
| C02 | H10 | sing | 1.09Å | 1.10Å | |
| C04 | H11 | sing | 1.09Å | 1.10Å | |
| C05 | 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 | |
| C07 | H16 | sing | 1.09Å | 1.10Å | |
| C07 | H17 | sing | 1.09Å | 1.10Å | |
| C08 | H18 | sing | 1.09Å | 1.10Å | |
| C08 | H19 | sing | 1.09Å | 1.10Å | |
| C16 | H20 | sing | 1.09Å | 1.10Å | |
| C16 | H21 | sing | 1.09Å | 1.10Å | |
| C17 | H22 | sing | 1.09Å | 1.10Å | |
| C17 | H23 | sing | 1.09Å | 1.10Å | |
| N11 | H24 | sing | 0.97Å | 1.00Å | |
| N15 | H25 | sing | 0.97Å | 1.00Å | |
| N25 | H26 | sing | 0.97Å | 1.00Å | |
| N25 | H27 | sing | 0.97Å | 1.00Å | |
| N31 | H28 | sing | 0.97Å | 1.00Å | |
| N34 | H29 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O13 | S12 | N11 | 104.7° | 106.4° |
| O13 | S12 | N15 | 112.9° | 106.4° |
| O13 | S12 | O14 | 117.3° | 123.2° |
| N11 | S12 | N15 | 104.8° | 107.2° |
| N11 | S12 | O14 | 110.8° | 106.4° |
| S12 | N11 | C09 | 130.5° | 120.0° |
| S12 | N11 | H24 | 114.8° | 120.0° |
| N15 | S12 | O14 | 105.8° | 106.4° |
| S12 | N15 | C16 | 121.7° | 120.0° |
| S12 | N15 | H25 | 106.3° | 120.0° |
| N11 | C09 | O10 | 109.3° | 120.0° |
| N11 | C09 | C08 | 131.8° | 120.0° |
| C09 | N11 | H24 | 114.7° | 120.0° |
| N15 | C16 | C17 | 111.1° | 109.5° |
| N15 | C16 | H20 | 109.0° | 109.5° |
| N15 | C16 | H21 | 109.0° | 109.5° |
| C16 | N15 | H25 | 106.3° | 120.0° |
| O10 | C09 | C08 | 118.7° | 120.0° |
| C09 | C08 | C07 | 112.3° | 109.4° |
| C09 | C08 | H18 | 108.8° | 109.4° |
| C09 | C08 | H19 | 108.8° | 109.5° |
| C16 | C17 | C18 | 113.4° | 109.5° |
| C17 | C16 | H20 | 109.1° | 109.4° |
| C17 | C16 | H21 | 109.1° | 109.5° |
| C16 | C17 | H22 | 108.5° | 109.5° |
| C16 | C17 | H23 | 108.5° | 109.5° |
| C17 | C18 | C19 | 115.0° | 109.5° |
| C17 | C18 | H2 | 108.1° | 109.5° |
| C17 | C18 | H3 | 108.1° | 109.4° |
| C18 | C17 | H22 | 108.5° | 109.4° |
| C18 | C17 | H23 | 108.5° | 109.4° |
| C08 | C07 | C06 | 122.2° | 109.4° |
| C08 | C07 | H16 | 106.2° | 109.5° |
| C08 | C07 | H17 | 106.2° | 109.5° |
| C07 | C08 | H18 | 108.8° | 109.5° |
| C07 | C08 | H19 | 108.8° | 109.5° |
| C18 | C19 | N20 | 114.4° | 109.5° |
| C19 | C18 | H2 | 108.1° | 109.5° |
| C19 | C18 | H3 | 108.1° | 109.4° |
| C18 | C19 | H4 | 108.2° | 109.5° |
| C18 | C19 | H5 | 108.2° | 109.5° |
| C19 | N20 | C29 | 129.6° | 126.3° |
| C19 | N20 | C21 | 124.3° | 126.2° |
| N20 | C19 | H4 | 108.2° | 109.4° |
| N20 | C19 | H5 | 108.2° | 109.5° |
| C27 | N28 | C29 | 115.3° | 120.6° |
| N28 | C27 | N26 | 127.2° | 122.5° |
| N28 | C27 | H6 | 116.4° | 118.7° |
| N28 | C29 | N20 | 129.1° | 134.9° |
| N28 | C29 | C23 | 123.1° | 119.1° |
| C07 | C06 | C05 | 114.1° | 109.4° |
| C07 | C06 | H14 | 108.3° | 109.5° |
| C07 | C06 | H15 | 108.3° | 109.5° |
| C06 | C07 | H16 | 106.2° | 109.5° |
| C06 | C07 | H17 | 106.2° | 109.5° |
| C27 | N26 | C24 | 118.8° | 121.2° |
| N26 | C27 | H6 | 116.4° | 118.8° |
| C06 | C05 | C04 | 115.6° | 109.4° |
| C06 | C05 | H12 | 107.9° | 109.4° |
| C06 | C05 | H13 | 107.9° | 109.5° |
| C05 | C06 | H14 | 108.3° | 109.5° |
| C05 | C06 | H15 | 108.3° | 109.5° |
| C29 | N20 | C21 | 106.1° | 107.5° |
| N20 | C29 | C23 | 107.9° | 106.0° |
| N20 | C21 | N22 | 111.0° | 110.0° |
| N20 | C21 | H1 | 124.5° | 125.1° |
| C29 | C23 | C24 | 118.0° | 118.2° |
| C29 | C23 | N22 | 107.9° | 107.2° |
| N26 | C24 | C23 | 117.7° | 118.4° |
| N26 | C24 | N25 | 116.8° | 120.8° |
| C21 | N22 | C23 | 107.1° | 109.4° |
| N22 | C21 | H1 | 124.5° | 125.0° |
| C24 | C23 | N22 | 134.1° | 134.7° |
| C23 | C24 | N25 | 125.5° | 120.8° |
| C05 | C04 | C30 | 117.8° | 110.7° |
| C05 | C04 | S03 | 110.6° | 110.8° |
| C05 | C04 | H11 | 109.8° | 110.8° |
| C04 | C05 | H12 | 107.9° | 109.5° |
| C04 | C05 | H13 | 107.9° | 109.5° |
| C24 | N25 | H26 | 109.5° | 120.0° |
| C24 | N25 | H27 | 109.5° | 120.0° |
| C30 | C04 | S03 | 101.2° | 102.8° |
| C04 | C30 | N31 | 110.6° | 109.2° |
| C04 | C30 | C01 | 111.2° | 112.4° |
| C04 | C30 | H7 | 110.2° | 110.5° |
| C30 | C04 | H11 | 109.8° | 110.7° |
| C04 | S03 | C02 | 91.0° | 94.8° |
| S03 | C04 | H11 | 106.9° | 110.8° |
| N31 | C30 | C01 | 101.9° | 104.1° |
| C30 | N31 | C32 | 115.6° | 109.0° |
| N31 | C30 | H7 | 112.8° | 110.3° |
| C30 | N31 | H28 | 122.2° | 125.5° |
| C30 | C01 | C02 | 105.6° | 112.4° |
| C30 | C01 | N34 | 105.8° | 104.0° |
| C01 | C30 | H7 | 109.9° | 110.3° |
| C30 | C01 | H8 | 111.5° | 110.3° |
| N31 | C32 | O33 | 129.4° | 123.1° |
| N31 | C32 | N34 | 107.7° | 113.9° |
| C32 | N31 | H28 | 122.2° | 125.5° |
| C02 | C01 | N34 | 107.8° | 109.2° |
| C01 | C02 | S03 | 107.4° | 102.7° |
| C02 | C01 | H8 | 112.2° | 110.3° |
| C01 | C02 | H9 | 110.0° | 110.7° |
| C01 | C02 | H10 | 110.0° | 110.8° |
| C01 | N34 | C32 | 109.0° | 109.0° |
| N34 | C01 | H8 | 113.4° | 110.6° |
| C01 | N34 | H29 | 125.5° | 125.5° |
| S03 | C02 | H9 | 110.0° | 110.8° |
| S03 | C02 | H10 | 110.0° | 110.9° |
| O33 | C32 | N34 | 122.9° | 123.0° |
| C32 | N34 | H29 | 125.5° | 125.5° |
| H2 | C18 | H3 | 109.4° | 109.5° |
| H4 | C19 | H5 | 109.5° | 109.5° |
| H9 | C02 | H10 | 109.5° | 110.6° |
| H12 | C05 | H13 | 109.5° | 109.5° |
| H14 | C06 | H15 | 109.4° | 109.5° |
| H16 | C07 | H17 | 109.5° | 109.5° |
| H18 | C08 | H19 | 109.5° | 109.5° |
| H20 | C16 | H21 | 109.5° | 109.4° |
| H22 | C17 | H23 | 109.4° | 109.5° |
| H26 | N25 | H27 | 109.4° | 119.9° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O13 | S12 | N11 | N15 | 119.0° | 113.5° |
| O13 | S12 | N11 | O14 | 127.3° | 133.0° |
| O13 | S12 | N15 | O14 | 129.5° | 133.0° |
| O13 | S12 | N11 | C09 | 115.6° | 178.5° |
| O13 | S12 | N15 | C16 | 156.4° | 48.5° |
| O13 | S12 | N11 | H24 | 64.4° | 1.4° |
| O13 | S12 | N15 | H25 | 81.9° | 131.4° |
| N11 | S12 | N15 | O14 | 117.2° | 113.5° |
| S12 | N11 | C09 | H24 | 180.0° | 179.9° |
| N11 | S12 | N15 | C16 | 43.1° | 65.0° |
| S12 | N11 | C09 | O10 | 179.8° | 0.1° |
| S12 | N11 | C09 | C08 | 4.1° | 180.0° |
| N11 | S12 | N15 | H25 | 164.8° | 115.1° |
| N15 | S12 | N11 | C09 | 125.4° | 65.0° |
| S12 | N15 | C16 | H25 | 121.7° | 179.9° |
| S12 | N15 | C16 | C17 | 114.7° | 164.9° |
| S12 | N15 | C16 | H20 | 5.5° | 45.0° |
| S12 | N15 | C16 | H21 | 125.0° | 75.0° |
| N15 | S12 | N11 | H24 | 54.6° | 114.9° |
| O14 | S12 | N11 | C09 | 11.8° | 48.6° |
| O14 | S12 | N15 | C16 | 74.1° | 178.5° |
| O14 | S12 | N11 | H24 | 168.2° | 131.6° |
| O14 | S12 | N15 | H25 | 47.6° | 1.5° |
| N11 | C09 | O10 | C08 | 176.4° | 179.9° |
| N11 | C09 | C08 | C07 | 121.7° | 180.0° |
| N11 | C09 | C08 | H18 | 117.9° | 60.0° |
| N11 | C09 | C08 | H19 | 1.3° | 60.0° |
| N15 | C16 | C17 | H20 | 120.2° | 120.0° |
| N15 | C16 | C17 | H21 | 120.2° | 120.1° |
| N15 | C16 | C17 | C18 | 119.9° | 180.0° |
| N15 | C16 | H20 | H21 | 119.2° | 120.0° |
| N15 | C16 | C17 | H22 | 0.7° | 60.1° |
| N15 | C16 | C17 | H23 | 119.5° | 60.0° |
| O10 | C09 | C08 | C07 | 53.7° | 0.0° |
| O10 | C09 | C08 | H18 | 66.8° | 120.0° |
| O10 | C09 | C08 | H19 | 174.1° | 119.9° |
| O10 | C09 | N11 | H24 | 0.2° | 179.9° |
| C09 | C08 | C07 | H18 | 120.4° | 119.9° |
| C09 | C08 | C07 | H19 | 120.4° | 120.0° |
| C09 | C08 | C07 | C06 | 111.9° | 180.0° |
| C09 | C08 | C07 | H16 | 126.4° | 60.1° |
| C09 | C08 | C07 | H17 | 9.9° | 60.0° |
| C09 | C08 | H18 | H19 | 118.7° | 120.0° |
| C08 | C09 | N11 | H24 | 175.9° | 0.1° |
| C16 | C17 | C18 | H22 | 120.6° | 120.0° |
| C16 | C17 | C18 | H23 | 120.6° | 120.0° |
| C16 | C17 | C18 | C19 | 156.6° | 179.9° |
| C16 | C17 | C18 | H2 | 35.8° | 60.0° |
| C16 | C17 | C18 | H3 | 82.6° | 60.0° |
| C17 | C16 | H20 | H21 | 119.3° | 120.0° |
| C16 | C17 | H22 | H23 | 118.2° | 120.1° |
| C17 | C16 | N15 | H25 | 123.6° | 15.0° |
| C17 | C18 | C19 | H2 | 120.8° | 120.0° |
| C17 | C18 | C19 | H3 | 120.8° | 119.9° |
| C17 | C18 | C19 | N20 | 69.8° | 180.0° |
| C17 | C18 | H2 | H3 | 117.5° | 120.0° |
| C17 | C18 | C19 | H4 | 169.5° | 60.1° |
| C17 | C18 | C19 | H5 | 51.0° | 60.0° |
| C18 | C17 | C16 | H20 | 119.9° | 60.0° |
| C18 | C17 | C16 | H21 | 0.3° | 59.9° |
| C18 | C17 | H22 | H23 | 118.3° | 119.9° |
| C08 | C07 | C06 | H16 | 121.7° | 120.0° |
| C08 | C07 | C06 | H17 | 121.8° | 120.0° |
| C08 | C07 | C06 | C05 | 171.5° | 180.0° |
| C08 | C07 | C06 | H14 | 50.8° | 60.0° |
| C08 | C07 | C06 | H15 | 67.8° | 60.0° |
| C08 | C07 | H16 | H17 | 114.3° | 120.1° |
| C07 | C08 | H18 | H19 | 118.7° | 120.1° |
| C18 | C19 | N20 | H4 | 120.7° | 120.0° |
| C18 | C19 | N20 | H5 | 120.7° | 120.1° |
| C18 | C19 | N20 | C29 | 122.7° | 85.0° |
| C18 | C19 | N20 | C21 | 56.7° | 95.1° |
| C19 | C18 | H2 | H3 | 117.5° | 120.0° |
| C18 | C19 | H4 | H5 | 117.8° | 120.0° |
| C19 | C18 | C17 | H22 | 82.8° | 60.0° |
| C19 | C18 | C17 | H23 | 36.0° | 60.0° |
| C19 | N20 | C29 | N28 | 0.5° | 0.1° |
| C19 | N20 | C29 | C21 | 179.4° | 180.0° |
| C19 | N20 | C29 | C23 | 179.9° | 179.8° |
| C19 | N20 | C21 | N22 | 179.8° | 179.9° |
| C19 | N20 | C21 | H1 | 0.2° | 0.3° |
| N20 | C19 | C18 | H2 | 51.1° | 59.9° |
| N20 | C19 | C18 | H3 | 169.4° | 60.1° |
| N20 | C19 | H4 | H5 | 117.7° | 120.0° |
| N28 | C27 | N26 | H6 | 180.0° | 179.1° |
| C27 | N28 | C29 | N20 | 179.5° | 179.9° |
| C27 | N28 | C29 | C23 | 0.2° | 0.0° |
| N28 | C27 | N26 | C24 | 0.6° | 0.9° |
| C29 | N28 | C27 | N26 | 0.2° | 0.4° |
| N28 | C29 | N20 | C23 | 179.4° | 179.9° |
| N28 | C29 | N20 | C21 | 178.9° | 179.8° |
| N28 | C29 | C23 | C24 | 0.2° | 0.0° |
| N28 | C29 | C23 | N22 | 179.3° | 179.6° |
| C29 | N28 | C27 | H6 | 179.7° | 179.5° |
| C07 | C06 | C05 | H14 | 120.7° | 120.0° |
| C07 | C06 | C05 | H15 | 120.7° | 120.0° |
| C07 | C06 | C05 | C04 | 157.0° | NaN° |
| C07 | C06 | C05 | H12 | 36.1° | 60.0° |
| C07 | C06 | C05 | H13 | 82.1° | 60.0° |
| C07 | C06 | H14 | H15 | 117.9° | 120.0° |
| C06 | C07 | H16 | H17 | 114.3° | 120.0° |
| C06 | C07 | C08 | H18 | 8.5° | 60.0° |
| C06 | C07 | C08 | H19 | 127.7° | 60.0° |
| C27 | N26 | C24 | C23 | 0.6° | 0.9° |
| C27 | N26 | C24 | N25 | 179.1° | 179.1° |
| C06 | C05 | C04 | H12 | 120.9° | 120.0° |
| C06 | C05 | C04 | H13 | 120.9° | 120.0° |
| C06 | C05 | C04 | C30 | 73.1° | 175.0° |
| C06 | C05 | C04 | S03 | 171.3° | 71.7° |
| C06 | C05 | C04 | H11 | 53.5° | 51.7° |
| C06 | C05 | H12 | H13 | 117.2° | 120.0° |
| C05 | C06 | H14 | H15 | 117.9° | 120.0° |
| C05 | C06 | C07 | H16 | 66.7° | 60.0° |
| C05 | C06 | C07 | H17 | 49.7° | 60.0° |
| C29 | N20 | C21 | N22 | 0.7° | 0.0° |
| N20 | C29 | C23 | C24 | 179.6° | 179.9° |
| N20 | C29 | C23 | N22 | 0.1° | 0.4° |
| C29 | N20 | C21 | H1 | 179.3° | 179.7° |
| C29 | N20 | C19 | H4 | 116.6° | 35.0° |
| C29 | N20 | C19 | H5 | 1.9° | 155.0° |
| C21 | N20 | C29 | C23 | 0.5° | 0.3° |
| N20 | C21 | N22 | H1 | 180.0° | 179.7° |
| N20 | C21 | N22 | C23 | 0.7° | 0.3° |
| C21 | N20 | C19 | H4 | 64.1° | 145.0° |
| C21 | N20 | C19 | H5 | 177.4° | 25.0° |
| C29 | C23 | C24 | N26 | 0.2° | 0.5° |
| C29 | C23 | N22 | C21 | 0.3° | 0.5° |
| C29 | C23 | C24 | N22 | 179.4° | 179.5° |
| C29 | C23 | C24 | N25 | 179.5° | 179.6° |
| N26 | C24 | C23 | N25 | 179.7° | 179.9° |
| N26 | C24 | C23 | N22 | 179.6° | 180.0° |
| C24 | N26 | C27 | H6 | 179.3° | 180.0° |
| N26 | C24 | N25 | H26 | 0.0° | 179.9° |
| N26 | C24 | N25 | H27 | 120.0° | 0.1° |
| C21 | N22 | C23 | C24 | 179.1° | 180.0° |
| C23 | C24 | N25 | H26 | 179.7° | 0.0° |
| C23 | C24 | N25 | H27 | 59.7° | 180.0° |
| N22 | C23 | C24 | N25 | 0.1° | 0.1° |
| C23 | N22 | C21 | H1 | 179.4° | 180.0° |
| C05 | C04 | C30 | S03 | 120.6° | 118.3° |
| C05 | C04 | C30 | H11 | 126.6° | 123.4° |
| C05 | C04 | S03 | H11 | 119.5° | 123.4° |
| C05 | C04 | C30 | N31 | 41.6° | 28.0° |
| C05 | C04 | C30 | C01 | 154.0° | 143.0° |
| C05 | C04 | S03 | C02 | 168.9° | 153.0° |
| C05 | C04 | C30 | H7 | 83.8° | 93.4° |
| C04 | C05 | H12 | H13 | 117.2° | 120.0° |
| C04 | C05 | C06 | H14 | 82.3° | 60.0° |
| C04 | C05 | C06 | H15 | 36.3° | 60.0° |
| C24 | N25 | H26 | H27 | 120.0° | 180.0° |
| C30 | C04 | S03 | H11 | 114.9° | 118.3° |
| C04 | C30 | N31 | C01 | 118.3° | 120.2° |
| C04 | C30 | N31 | H7 | 123.9° | 121.6° |
| C04 | C30 | C01 | H7 | 122.3° | 123.7° |
| C04 | C30 | N31 | C32 | 118.2° | 120.2° |
| C04 | C30 | C01 | C02 | 4.6° | 0.0° |
| C04 | C30 | C01 | N34 | 118.7° | 118.0° |
| C30 | C04 | S03 | C02 | 43.3° | 34.7° |
| C04 | C30 | C01 | H8 | 117.6° | 123.4° |
| C30 | C04 | C05 | H12 | 47.8° | 65.0° |
| C30 | C04 | C05 | H13 | 166.0° | 55.0° |
| C04 | C30 | N31 | H28 | 61.9° | 59.9° |
| S03 | C04 | C30 | N31 | 79.0° | 90.3° |
| S03 | C04 | C30 | C01 | 33.4° | 24.6° |
| C04 | S03 | C02 | C01 | 43.6° | 34.7° |
| S03 | C04 | C30 | H7 | 155.6° | 148.2° |
| C04 | S03 | C02 | H9 | 76.1° | 83.6° |
| C04 | S03 | C02 | H10 | 163.3° | 153.1° |
| S03 | C04 | C05 | H12 | 67.8° | 48.3° |
| S03 | C04 | C05 | H13 | 50.4° | 168.3° |
| N31 | C30 | C01 | H7 | 119.8° | 118.3° |
| C30 | N31 | C32 | H28 | 180.0° | 179.9° |
| N31 | C30 | C01 | C02 | 113.3° | 118.0° |
| N31 | C30 | C01 | N34 | 0.9° | 0.0° |
| C30 | N31 | C32 | O33 | 179.9° | 180.0° |
| C30 | N31 | C32 | N34 | 1.1° | 0.1° |
| N31 | C30 | C01 | H8 | 124.6° | 118.6° |
| N31 | C30 | C04 | H11 | 168.2° | 151.4° |
| C01 | C30 | N31 | C32 | 0.1° | 0.0° |
| C30 | C01 | C02 | N34 | 112.8° | 114.9° |
| C30 | C01 | C02 | H8 | 121.7° | 123.5° |
| C30 | C01 | N34 | H8 | 122.5° | 118.4° |
| C30 | C01 | C02 | S03 | 27.9° | 24.6° |
| C30 | C01 | N34 | C32 | 1.6° | 0.0° |
| C30 | C01 | C02 | H9 | 91.8° | 93.7° |
| C30 | C01 | C02 | H10 | 147.5° | 143.1° |
| C01 | C30 | C04 | H11 | 79.3° | 93.7° |
| C01 | C30 | N31 | H28 | 179.9° | 180.0° |
| C30 | C01 | N34 | H29 | 178.5° | 179.9° |
| N31 | C32 | N34 | C01 | 1.7° | 0.1° |
| N31 | C32 | O33 | N34 | 178.9° | 180.0° |
| C32 | N31 | C30 | H7 | 117.9° | 118.2° |
| N31 | C32 | N34 | H29 | 178.4° | 179.9° |
| C02 | C01 | N34 | H8 | 124.9° | 121.5° |
| C01 | C02 | S03 | H9 | 119.7° | 118.3° |
| C01 | C02 | S03 | H10 | 119.7° | 118.4° |
| C02 | C01 | N34 | C32 | 111.1° | 120.2° |
| C02 | C01 | C30 | H7 | 126.9° | 123.8° |
| C01 | C02 | H9 | H10 | 120.9° | 123.2° |
| C02 | C01 | N34 | H29 | 68.9° | 59.9° |
| N34 | C01 | C02 | S03 | 84.9° | 90.3° |
| C01 | N34 | C32 | O33 | 179.2° | 180.0° |
| C01 | N34 | C32 | H29 | 180.0° | 179.9° |
| N34 | C01 | C30 | H7 | 118.9° | 118.3° |
| N34 | C01 | C02 | H9 | 155.4° | 151.4° |
| N34 | C01 | C02 | H10 | 34.7° | 28.3° |
| S03 | C02 | C01 | H8 | 149.5° | 148.1° |
| S03 | C02 | H9 | H10 | 121.0° | 123.5° |
| C02 | S03 | C04 | H11 | 71.6° | 83.6° |
| O33 | C32 | N31 | H28 | 0.2° | 0.0° |
| O33 | C32 | N34 | H29 | 0.7° | 0.1° |
| C32 | N34 | C01 | H8 | 124.0° | 118.3° |
| N34 | C32 | N31 | H28 | 178.9° | 180.0° |
| H2 | C18 | C19 | H4 | 69.6° | 60.0° |
| H2 | C18 | C19 | H5 | 171.8° | 180.0° |
| H2 | C18 | C17 | H22 | 156.3° | 180.0° |
| H2 | C18 | C17 | H23 | 84.8° | 60.0° |
| H3 | C18 | C19 | H4 | 48.7° | 180.0° |
| H3 | C18 | C19 | H5 | 69.9° | 60.0° |
| H3 | C18 | C17 | H22 | 38.0° | 60.0° |
| H3 | C18 | C17 | H23 | 156.8° | 180.0° |
| H7 | C30 | C01 | H8 | 4.8° | 0.3° |
| H7 | C30 | C04 | H11 | 42.8° | 29.9° |
| H7 | C30 | N31 | H28 | 62.1° | 61.7° |
| H8 | C01 | C02 | H9 | 29.8° | 29.8° |
| H8 | C01 | C02 | H10 | 90.8° | 93.4° |
| H8 | C01 | N34 | H29 | 56.0° | 61.5° |
| H11 | C04 | C05 | H12 | 174.4° | 171.7° |
| H11 | C04 | C05 | H13 | 67.4° | 68.3° |
| H12 | C05 | C06 | H14 | 156.8° | 180.0° |
| H12 | C05 | C06 | H15 | 84.6° | 60.0° |
| H13 | C05 | C06 | H14 | 38.6° | 59.9° |
| H13 | C05 | C06 | H15 | 157.2° | 180.0° |
| H14 | C06 | C07 | H16 | 172.6° | NaN° |
| H14 | C06 | C07 | H17 | 71.0° | 59.9° |
| H15 | C06 | C07 | H16 | 53.9° | 59.9° |
| H15 | C06 | C07 | H17 | 170.4° | 180.0° |
| H16 | C07 | C08 | H18 | 113.2° | 180.0° |
| H16 | C07 | C08 | H19 | 6.0° | 59.9° |
| H17 | C07 | C08 | H18 | 130.3° | 59.9° |
| H17 | C07 | C08 | H19 | 110.5° | 180.0° |
| H20 | C16 | C17 | H22 | 119.5° | 180.0° |
| H20 | C16 | C17 | H23 | 0.7° | 60.0° |
| H20 | C16 | N15 | H25 | 116.2° | 134.9° |
| H21 | C16 | C17 | H22 | 120.9° | 60.0° |
| H21 | C16 | C17 | H23 | 120.3° | 179.9° |
| H21 | C16 | N15 | H25 | 3.3° | 105.1° |
