4MH
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C01 | C02 | sing | 1.53Å | 1.53Å | |
| C02 | C03 | sing | 1.53Å | 1.52Å | |
| C03 | C04 | sing | 1.53Å | 1.54Å | |
| C04 | N05 | sing | 1.46Å | 1.43Å | |
| N05 | C06 | sing | 1.38Å | 1.46Å | |
| C06 | N07 | doub | 1.33Å | 1.35Å | Aromatic |
| C06 | N33 | sing | 1.33Å | 1.38Å | Aromatic |
| N07 | C08 | sing | 1.32Å | 1.37Å | Aromatic |
| C08 | C09 | doub | 1.40Å | 1.41Å | Aromatic |
| C09 | C10 | sing | 1.47Å | 1.54Å | |
| C09 | C24 | sing | 1.41Å | 1.43Å | Aromatic |
| C10 | O11 | doub | 1.22Å | 1.21Å | |
| C10 | N12 | sing | 1.35Å | 1.46Å | |
| N12 | C13 | sing | 1.46Å | 1.43Å | |
| C13 | C14 | sing | 1.51Å | 1.55Å | |
| C14 | C15 | doub | 1.38Å | 1.38Å | Aromatic |
| C14 | C19 | sing | 1.38Å | 1.39Å | Aromatic |
| C15 | C16 | sing | 1.38Å | 1.40Å | Aromatic |
| C16 | C17 | doub | 1.38Å | 1.39Å | Aromatic |
| C17 | C18 | sing | 1.38Å | 1.38Å | Aromatic |
| C17 | S20 | sing | 1.76Å | 1.77Å | |
| C18 | C19 | doub | 1.38Å | 1.39Å | Aromatic |
| S20 | O21 | doub | 1.42Å | 1.43Å | |
| S20 | O22 | doub | 1.42Å | 1.43Å | |
| S20 | N23 | sing | 1.66Å | 1.65Å | |
| C24 | N25 | sing | 1.38Å | 1.46Å | |
| C24 | N33 | doub | 1.33Å | 1.35Å | Aromatic |
| N25 | C26 | sing | 1.46Å | 1.43Å | |
| C26 | C27 | sing | 1.53Å | 1.52Å | |
| C26 | C32 | sing | 1.53Å | 1.53Å | |
| C27 | C28 | sing | 1.53Å | 1.51Å | |
| C28 | C29 | sing | 1.53Å | 1.52Å | |
| C29 | O30 | sing | 1.43Å | 1.42Å | |
| C29 | C31 | sing | 1.53Å | 1.52Å | |
| C31 | C32 | sing | 1.53Å | 1.51Å | |
| C01 | H011 | sing | 1.09Å | 1.10Å | |
| C01 | H012 | sing | 1.09Å | 1.10Å | |
| C01 | H013 | sing | 1.09Å | 1.10Å | |
| C02 | H021 | sing | 1.09Å | 1.10Å | |
| C02 | H022 | sing | 1.09Å | 1.10Å | |
| C03 | H031 | sing | 1.09Å | 1.10Å | |
| C03 | H032 | sing | 1.09Å | 1.10Å | |
| C04 | H041 | sing | 1.09Å | 1.10Å | |
| C04 | H042 | sing | 1.09Å | 1.10Å | |
| N05 | H051 | sing | 0.97Å | 1.00Å | |
| C08 | H081 | sing | 1.08Å | 1.08Å | |
| N12 | H121 | sing | 0.97Å | 1.00Å | |
| C13 | H131 | sing | 1.09Å | 1.10Å | |
| C13 | H132 | sing | 1.09Å | 1.10Å | |
| C15 | H151 | sing | 1.08Å | 1.08Å | |
| C16 | H161 | sing | 1.08Å | 1.08Å | |
| C18 | H181 | sing | 1.08Å | 1.08Å | |
| C19 | H191 | sing | 1.08Å | 1.08Å | |
| N23 | H231 | sing | 0.97Å | 1.00Å | |
| N23 | H232 | sing | 0.97Å | 1.00Å | |
| N25 | H251 | sing | 0.97Å | 1.00Å | |
| C26 | H261 | sing | 1.09Å | 1.10Å | |
| C27 | H271 | sing | 1.09Å | 1.10Å | |
| C27 | H272 | sing | 1.09Å | 1.10Å | |
| C28 | H281 | sing | 1.09Å | 1.10Å | |
| C28 | H282 | sing | 1.09Å | 1.10Å | |
| C29 | H291 | sing | 1.09Å | 1.10Å | |
| O30 | H301 | sing | 0.97Å | 0.95Å | |
| C31 | H311 | sing | 1.09Å | 1.10Å | |
| C31 | H312 | sing | 1.09Å | 1.10Å | |
| C32 | H321 | sing | 1.09Å | 1.10Å | |
| C32 | H322 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C01 | C02 | C03 | 111.8° | 109.5° |
| C02 | C01 | H011 | 109.5° | 109.5° |
| C02 | C01 | H012 | 109.5° | 109.5° |
| C02 | C01 | H013 | 109.5° | 109.5° |
| C01 | C02 | H021 | 108.9° | 109.5° |
| C01 | C02 | H022 | 108.9° | 109.5° |
| C02 | C03 | C04 | 112.8° | 109.5° |
| C03 | C02 | H021 | 108.9° | 109.5° |
| C03 | C02 | H022 | 108.9° | 109.5° |
| C02 | C03 | H031 | 108.6° | 109.5° |
| C02 | C03 | H032 | 108.6° | 109.5° |
| C03 | C04 | N05 | 109.9° | 109.5° |
| C04 | C03 | H031 | 108.6° | 109.5° |
| C04 | C03 | H032 | 108.6° | 109.5° |
| C03 | C04 | H041 | 109.4° | 109.4° |
| C03 | C04 | H042 | 109.4° | 109.4° |
| C04 | N05 | C06 | 120.6° | 120.0° |
| N05 | C04 | H041 | 109.4° | 109.5° |
| N05 | C04 | H042 | 109.4° | 109.5° |
| C04 | N05 | H051 | 106.6° | 120.0° |
| N05 | C06 | N07 | 120.3° | 119.0° |
| N05 | C06 | N33 | 118.6° | 119.0° |
| C06 | N05 | H051 | 106.6° | 120.0° |
| N07 | C06 | N33 | 121.1° | 122.0° |
| C06 | N07 | C08 | 119.6° | 121.1° |
| C06 | N33 | C24 | 121.7° | 120.8° |
| N07 | C08 | C09 | 120.6° | 119.1° |
| N07 | C08 | H081 | 119.7° | 120.5° |
| C08 | C09 | C10 | 120.3° | 121.0° |
| C08 | C09 | C24 | 118.3° | 118.1° |
| C09 | C08 | H081 | 119.7° | 120.4° |
| C10 | C09 | C24 | 121.4° | 120.9° |
| C09 | C10 | O11 | 120.1° | 120.1° |
| C09 | C10 | N12 | 118.8° | 120.0° |
| C09 | C24 | N25 | 120.8° | 120.6° |
| C09 | C24 | N33 | 118.6° | 118.8° |
| O11 | C10 | N12 | 121.1° | 119.9° |
| C10 | N12 | C13 | 122.2° | 120.0° |
| C10 | N12 | H121 | 118.9° | 120.0° |
| N12 | C13 | C14 | 110.2° | 109.5° |
| C13 | N12 | H121 | 118.9° | 120.0° |
| N12 | C13 | H131 | 109.3° | 109.5° |
| N12 | C13 | H132 | 109.3° | 109.5° |
| C13 | C14 | C15 | 120.2° | 120.0° |
| C13 | C14 | C19 | 119.8° | 120.0° |
| C14 | C13 | H131 | 109.3° | 109.5° |
| C14 | C13 | H132 | 109.3° | 109.5° |
| C15 | C14 | C19 | 120.1° | 120.0° |
| C14 | C15 | C16 | 119.9° | 120.0° |
| C14 | C15 | H151 | 120.0° | 120.0° |
| C14 | C19 | C18 | 120.0° | 120.0° |
| C14 | C19 | H191 | 120.0° | 120.0° |
| C15 | C16 | C17 | 119.9° | 120.0° |
| C16 | C15 | H151 | 120.0° | 120.0° |
| C15 | C16 | H161 | 120.1° | 120.0° |
| C16 | C17 | C18 | 120.2° | 120.0° |
| C16 | C17 | S20 | 120.2° | 120.0° |
| C17 | C16 | H161 | 120.0° | 120.0° |
| C18 | C17 | S20 | 119.7° | 120.0° |
| C17 | C18 | C19 | 119.9° | 120.0° |
| C17 | C18 | H181 | 120.0° | 120.0° |
| C17 | S20 | O21 | 110.8° | 106.4° |
| C17 | S20 | O22 | 111.2° | 106.4° |
| C17 | S20 | N23 | 110.5° | 107.2° |
| C19 | C18 | H181 | 120.0° | 120.0° |
| C18 | C19 | H191 | 120.0° | 120.1° |
| O21 | S20 | O22 | 101.3° | 123.2° |
| O21 | S20 | N23 | 111.1° | 106.3° |
| O22 | S20 | N23 | 111.7° | 106.4° |
| S20 | N23 | H231 | 109.5° | 120.0° |
| S20 | N23 | H232 | 109.5° | 120.0° |
| N25 | C24 | N33 | 120.6° | 120.6° |
| C24 | N25 | C26 | 122.9° | 119.9° |
| C24 | N25 | H251 | 106.0° | 120.0° |
| N25 | C26 | C27 | 107.2° | 109.5° |
| N25 | C26 | C32 | 111.4° | 109.5° |
| C26 | N25 | H251 | 106.0° | 120.0° |
| N25 | C26 | H261 | 109.5° | 109.5° |
| C27 | C26 | C32 | 111.8° | 109.4° |
| C26 | C27 | C28 | 113.0° | 109.5° |
| C27 | C26 | H261 | 108.4° | 109.4° |
| C26 | C27 | H271 | 108.5° | 109.5° |
| C26 | C27 | H272 | 108.6° | 109.5° |
| C26 | C32 | C31 | 112.4° | 109.5° |
| C32 | C26 | H261 | 108.3° | 109.5° |
| C26 | C32 | H321 | 108.7° | 109.4° |
| C26 | C32 | H322 | 108.7° | 109.5° |
| C27 | C28 | C29 | 111.9° | 109.4° |
| C28 | C27 | H271 | 108.6° | 109.5° |
| C28 | C27 | H272 | 108.6° | 109.4° |
| C27 | C28 | H281 | 108.8° | 109.5° |
| C27 | C28 | H282 | 108.8° | 109.5° |
| C28 | C29 | O30 | 109.3° | 109.5° |
| C28 | C29 | C31 | 111.4° | 109.5° |
| C29 | C28 | H281 | 108.8° | 109.5° |
| C29 | C28 | H282 | 108.8° | 109.4° |
| C28 | C29 | H291 | 108.5° | 109.5° |
| O30 | C29 | C31 | 109.1° | 109.5° |
| O30 | C29 | H291 | 109.9° | 109.5° |
| C29 | O30 | H301 | 109.5° | 114.0° |
| C29 | C31 | C32 | 111.7° | 109.5° |
| C31 | C29 | H291 | 108.6° | 109.5° |
| C29 | C31 | H311 | 108.9° | 109.5° |
| C29 | C31 | H312 | 108.9° | 109.5° |
| C32 | C31 | H311 | 108.9° | 109.4° |
| C32 | C31 | H312 | 108.9° | 109.5° |
| C31 | C32 | H321 | 108.7° | 109.5° |
| C31 | C32 | H322 | 108.7° | 109.5° |
| H011 | C01 | H012 | 109.5° | 109.5° |
| H011 | C01 | H013 | 109.5° | 109.5° |
| H012 | C01 | H013 | 109.4° | 109.5° |
| H021 | C02 | H022 | 109.5° | 109.5° |
| H031 | C03 | H032 | 109.5° | 109.4° |
| H041 | C04 | H042 | 109.4° | 109.4° |
| H131 | C13 | H132 | 109.5° | 109.5° |
| H231 | N23 | H232 | 109.5° | 120.0° |
| H271 | C27 | H272 | 109.5° | 109.4° |
| H281 | C28 | H282 | 109.5° | 109.5° |
| H311 | C31 | H312 | 109.4° | 109.5° |
| H321 | C32 | H322 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C01 | C02 | C03 | H021 | 120.3° | 120.0° |
| C01 | C02 | C03 | H022 | 120.4° | 120.0° |
| C01 | C02 | C03 | C04 | 148.0° | 180.0° |
| C02 | C01 | H011 | H012 | 120.0° | 120.0° |
| C02 | C01 | H011 | H013 | 120.0° | 120.0° |
| C02 | C01 | H012 | H013 | 120.0° | 120.0° |
| C01 | C02 | H021 | H022 | 118.9° | 120.0° |
| C01 | C02 | C03 | H031 | 91.5° | 60.0° |
| C01 | C02 | C03 | H032 | 27.6° | 60.0° |
| C02 | C03 | C04 | H031 | 120.5° | 120.0° |
| C02 | C03 | C04 | H032 | 120.5° | 120.0° |
| C02 | C03 | C04 | N05 | 69.3° | 180.0° |
| C03 | C02 | C01 | H011 | 180.0° | 180.0° |
| C03 | C02 | C01 | H012 | 60.0° | 60.0° |
| C03 | C02 | C01 | H013 | 60.0° | 60.0° |
| C03 | C02 | H021 | H022 | 118.9° | 120.0° |
| C02 | C03 | H031 | H032 | 118.5° | 120.0° |
| C02 | C03 | C04 | H041 | 50.8° | 59.9° |
| C02 | C03 | C04 | H042 | 170.7° | 60.0° |
| C03 | C04 | N05 | H041 | 120.1° | 120.0° |
| C03 | C04 | N05 | H042 | 120.1° | 120.0° |
| C03 | C04 | N05 | C06 | 84.7° | 180.0° |
| C04 | C03 | C02 | H021 | 27.7° | 60.0° |
| C04 | C03 | C02 | H022 | 91.6° | 60.0° |
| C04 | C03 | H031 | H032 | 118.5° | 120.0° |
| C03 | C04 | H041 | H042 | 119.8° | 119.9° |
| C03 | C04 | N05 | H051 | 36.8° | 0.0° |
| C04 | N05 | C06 | H051 | 121.6° | 180.0° |
| C04 | N05 | C06 | N07 | 53.7° | 0.0° |
| C04 | N05 | C06 | N33 | 126.4° | 179.7° |
| N05 | C04 | C03 | H031 | 170.2° | 60.0° |
| N05 | C04 | C03 | H032 | 51.2° | 60.0° |
| N05 | C04 | H041 | H042 | 119.8° | 120.0° |
| N05 | C06 | N07 | N33 | 179.9° | 179.7° |
| N05 | C06 | N07 | C08 | 180.0° | 180.0° |
| N05 | C06 | N33 | C24 | 179.5° | 179.8° |
| C06 | N05 | C04 | H041 | 155.2° | 59.9° |
| C06 | N05 | C04 | H042 | 35.4° | 60.0° |
| C06 | N07 | C08 | C09 | 0.1° | 0.0° |
| N07 | C06 | N33 | C24 | 0.6° | 0.5° |
| N07 | C06 | N05 | H051 | 175.2° | 180.0° |
| C06 | N07 | C08 | H081 | 179.8° | 180.0° |
| N33 | C06 | N07 | C08 | 0.1° | 0.3° |
| C06 | N33 | C24 | C09 | 0.9° | 0.5° |
| C06 | N33 | C24 | N25 | 179.9° | 179.8° |
| N33 | C06 | N05 | H051 | 4.9° | 0.3° |
| N07 | C08 | C09 | H081 | 180.0° | 180.0° |
| N07 | C08 | C09 | C10 | 180.0° | 180.0° |
| N07 | C08 | C09 | C24 | 0.1° | 0.0° |
| C08 | C09 | C10 | C24 | 180.0° | 180.0° |
| C08 | C09 | C10 | O11 | 164.9° | 174.4° |
| C08 | C09 | C10 | N12 | 15.5° | 5.7° |
| C08 | C09 | C24 | N25 | 179.6° | 180.0° |
| C08 | C09 | C24 | N33 | 0.6° | 0.2° |
| C09 | C10 | O11 | N12 | 179.6° | 179.9° |
| C09 | C10 | N12 | C13 | 179.8° | 180.0° |
| C10 | C09 | C24 | N25 | 0.5° | 0.0° |
| C10 | C09 | C24 | N33 | 179.5° | 179.7° |
| C10 | C09 | C08 | H081 | 0.0° | 0.0° |
| C09 | C10 | N12 | H121 | 0.1° | 0.1° |
| C24 | C09 | C10 | O11 | 15.1° | 5.6° |
| C24 | C09 | C10 | N12 | 164.5° | 174.3° |
| C09 | C24 | N25 | N33 | 179.0° | 179.8° |
| C09 | C24 | N25 | C26 | 117.4° | 174.6° |
| C24 | C09 | C08 | H081 | 179.9° | 180.0° |
| C09 | C24 | N25 | H251 | 120.7° | 5.4° |
| O11 | C10 | N12 | C13 | 0.6° | 0.1° |
| O11 | C10 | N12 | H121 | 179.5° | 180.0° |
| C10 | N12 | C13 | H121 | 180.0° | 179.9° |
| C10 | N12 | C13 | C14 | 125.1° | 179.9° |
| C10 | N12 | C13 | H131 | 114.8° | 59.9° |
| C10 | N12 | C13 | H132 | 4.9° | 60.1° |
| N12 | C13 | C14 | H131 | 120.1° | 120.0° |
| N12 | C13 | C14 | H132 | 120.1° | 120.0° |
| N12 | C13 | C14 | C15 | 64.2° | 90.0° |
| N12 | C13 | C14 | C19 | 115.8° | 90.3° |
| N12 | C13 | H131 | H132 | 119.6° | 120.0° |
| C13 | C14 | C15 | C19 | 179.9° | 179.7° |
| C13 | C14 | C15 | C16 | 179.9° | 180.0° |
| C13 | C14 | C19 | C18 | 179.8° | 179.8° |
| C14 | C13 | N12 | H121 | 55.0° | 0.0° |
| C14 | C13 | H131 | H132 | 119.7° | 120.0° |
| C13 | C14 | C15 | H151 | 0.1° | 0.0° |
| C13 | C14 | C19 | H191 | 0.3° | 0.0° |
| C14 | C15 | C16 | H151 | 180.0° | 180.0° |
| C14 | C15 | C16 | C17 | 0.4° | 0.0° |
| C15 | C14 | C19 | C18 | 0.2° | 0.5° |
| C15 | C14 | C13 | H131 | 175.7° | 30.0° |
| C15 | C14 | C13 | H132 | 55.9° | 150.0° |
| C14 | C15 | C16 | H161 | 179.6° | 180.0° |
| C15 | C14 | C19 | H191 | 179.8° | 179.7° |
| C19 | C14 | C15 | C16 | 0.2° | 0.3° |
| C14 | C19 | C18 | C17 | 0.3° | 0.4° |
| C14 | C19 | C18 | H191 | 180.0° | 179.8° |
| C19 | C14 | C13 | H131 | 4.4° | 149.7° |
| C19 | C14 | C13 | H132 | 124.1° | 29.7° |
| C19 | C14 | C15 | H151 | 179.8° | 179.7° |
| C14 | C19 | C18 | H181 | 179.7° | 179.7° |
| C15 | C16 | C17 | H161 | 180.0° | 180.0° |
| C15 | C16 | C17 | C18 | 0.3° | 0.0° |
| C15 | C16 | C17 | S20 | 179.8° | 179.9° |
| C16 | C17 | C18 | S20 | 179.9° | 180.0° |
| C16 | C17 | C18 | C19 | 0.1° | 0.2° |
| C16 | C17 | S20 | O21 | 147.1° | 156.5° |
| C16 | C17 | S20 | O22 | 35.3° | 23.5° |
| C16 | C17 | S20 | N23 | 89.3° | 90.0° |
| C17 | C16 | C15 | H151 | 179.6° | 180.0° |
| C16 | C17 | C18 | H181 | 180.0° | 180.0° |
| C17 | C18 | C19 | H181 | 180.0° | 179.8° |
| C18 | C17 | S20 | O21 | 33.0° | 23.5° |
| C18 | C17 | S20 | O22 | 144.8° | 156.4° |
| C18 | C17 | S20 | N23 | 90.7° | 90.0° |
| C18 | C17 | C16 | H161 | 179.7° | 180.0° |
| C17 | C18 | C19 | H191 | 179.7° | 179.8° |
| S20 | C17 | C18 | C19 | 179.8° | 179.8° |
| C17 | S20 | O21 | O22 | 118.0° | 123.0° |
| C17 | S20 | O21 | N23 | 123.2° | 114.1° |
| C17 | S20 | O22 | N23 | 123.9° | 114.1° |
| S20 | C17 | C16 | H161 | 0.2° | 0.0° |
| S20 | C17 | C18 | H181 | 0.1° | 0.0° |
| C17 | S20 | N23 | H231 | 180.0° | 150.0° |
| C17 | S20 | N23 | H232 | 60.0° | 30.0° |
| O21 | S20 | O22 | N23 | 118.4° | 122.9° |
| O21 | S20 | N23 | H231 | 56.6° | 36.5° |
| O21 | S20 | N23 | H232 | 63.4° | 143.5° |
| O22 | S20 | N23 | H231 | 55.7° | 96.4° |
| O22 | S20 | N23 | H232 | 175.7° | 83.6° |
| S20 | N23 | H231 | H232 | 120.0° | 180.0° |
| C24 | N25 | C26 | H251 | 121.9° | 180.0° |
| C24 | N25 | C26 | C27 | 150.2° | 155.0° |
| C24 | N25 | C26 | C32 | 27.5° | 85.0° |
| C24 | N25 | C26 | H261 | 92.4° | 35.1° |
| N33 | C24 | N25 | C26 | 63.6° | 5.6° |
| N33 | C24 | N25 | H251 | 58.2° | 174.4° |
| N25 | C26 | C27 | C32 | 122.4° | 120.0° |
| N25 | C26 | C27 | H261 | 118.2° | 120.1° |
| N25 | C26 | C32 | H261 | 120.6° | 120.1° |
| N25 | C26 | C27 | C28 | 173.3° | 180.0° |
| N25 | C26 | C32 | C31 | 171.4° | 180.0° |
| N25 | C26 | C27 | H271 | 52.7° | 60.0° |
| N25 | C26 | C27 | H272 | 66.2° | 60.0° |
| N25 | C26 | C32 | H321 | 68.1° | 60.1° |
| N25 | C26 | C32 | H322 | 51.0° | 59.9° |
| C27 | C26 | C32 | H261 | 119.4° | 119.9° |
| C26 | C27 | C28 | H271 | 120.5° | 120.1° |
| C26 | C27 | C28 | H272 | 120.5° | 120.0° |
| C26 | C27 | C28 | C29 | 52.5° | 60.0° |
| C27 | C26 | C32 | C31 | 51.5° | 60.0° |
| C27 | C26 | N25 | H251 | 28.3° | 25.0° |
| C26 | C27 | H271 | H272 | 118.4° | 120.0° |
| C26 | C27 | C28 | H281 | 172.9° | 180.0° |
| C26 | C27 | C28 | H282 | 67.9° | 59.9° |
| C27 | C26 | C32 | H321 | 171.9° | 179.9° |
| C27 | C26 | C32 | H322 | 69.0° | 60.0° |
| C32 | C26 | C27 | C28 | 50.8° | 60.0° |
| C26 | C32 | C31 | C29 | 53.9° | 60.1° |
| C26 | C32 | C31 | H321 | 120.4° | 119.9° |
| C26 | C32 | C31 | H322 | 120.4° | 120.0° |
| C32 | C26 | N25 | H251 | 94.3° | 94.9° |
| C32 | C26 | C27 | H271 | 69.7° | 60.0° |
| C32 | C26 | C27 | H272 | 171.4° | 180.0° |
| C26 | C32 | C31 | H311 | 174.3° | 180.0° |
| C26 | C32 | C31 | H312 | 66.4° | 60.0° |
| C26 | C32 | H321 | H322 | 118.6° | 120.0° |
| C27 | C28 | C29 | H281 | 120.4° | 120.0° |
| C27 | C28 | C29 | H282 | 120.3° | 119.9° |
| C27 | C28 | C29 | O30 | 174.9° | 180.0° |
| C27 | C28 | C29 | C31 | 54.2° | 60.0° |
| C28 | C27 | C26 | H261 | 68.5° | 59.9° |
| C28 | C27 | H271 | H272 | 118.4° | 119.9° |
| C27 | C28 | H281 | H282 | 118.9° | 120.0° |
| C27 | C28 | C29 | H291 | 65.3° | 60.0° |
| C28 | C29 | O30 | C31 | 122.1° | 120.0° |
| C28 | C29 | O30 | H291 | 119.0° | 120.0° |
| C28 | C29 | C31 | H291 | 119.5° | 120.0° |
| C28 | C29 | C31 | C32 | 55.0° | 60.0° |
| C29 | C28 | C27 | H271 | 68.0° | 60.1° |
| C29 | C28 | C27 | H272 | 173.0° | 180.0° |
| C29 | C28 | H281 | H282 | 118.9° | 120.0° |
| C28 | C29 | O30 | H301 | 180.0° | 180.0° |
| C28 | C29 | C31 | H311 | 175.4° | 180.0° |
| C28 | C29 | C31 | H312 | 65.4° | 60.0° |
| O30 | C29 | C31 | H291 | 119.7° | 120.0° |
| O30 | C29 | C31 | C32 | 175.8° | 180.0° |
| O30 | C29 | C28 | H281 | 64.7° | 60.0° |
| O30 | C29 | C28 | H282 | 54.5° | 60.0° |
| O30 | C29 | C31 | H311 | 63.8° | 60.0° |
| O30 | C29 | C31 | H312 | 55.5° | 60.0° |
| C29 | C31 | C32 | H311 | 120.3° | 120.0° |
| C29 | C31 | C32 | H312 | 120.3° | 120.1° |
| C31 | C29 | C28 | H281 | 174.6° | 180.0° |
| C31 | C29 | C28 | H282 | 66.1° | 60.0° |
| C31 | C29 | O30 | H301 | 57.9° | 60.0° |
| C29 | C31 | H311 | H312 | 118.9° | 120.0° |
| C29 | C31 | C32 | H321 | 174.4° | 180.0° |
| C29 | C31 | C32 | H322 | 66.5° | 59.9° |
| C31 | C32 | C26 | H261 | 68.0° | 59.9° |
| C32 | C31 | C29 | H291 | 64.5° | 60.0° |
| C32 | C31 | H311 | H312 | 119.0° | 120.0° |
| C31 | C32 | H321 | H322 | 118.7° | 120.1° |
| H011 | C01 | H012 | H013 | 120.0° | 120.0° |
| H011 | C01 | C02 | H021 | 59.6° | 60.0° |
| H011 | C01 | C02 | H022 | 59.7° | 60.0° |
| H012 | C01 | C02 | H021 | 60.4° | 60.0° |
| H012 | C01 | C02 | H022 | 179.7° | 180.0° |
| H013 | C01 | C02 | H021 | 179.6° | 180.0° |
| H013 | C01 | C02 | H022 | 60.3° | 60.0° |
| H021 | C02 | C03 | H031 | 148.2° | 180.0° |
| H021 | C02 | C03 | H032 | 92.8° | 60.0° |
| H022 | C02 | C03 | H031 | 28.9° | 60.0° |
| H022 | C02 | C03 | H032 | 147.9° | 180.0° |
| H031 | C03 | C04 | H041 | 69.7° | 180.0° |
| H031 | C03 | C04 | H042 | 50.2° | 60.1° |
| H032 | C03 | C04 | H041 | 171.3° | 60.1° |
| H032 | C03 | C04 | H042 | 68.9° | 180.0° |
| H041 | C04 | N05 | H051 | 83.2° | 120.0° |
| H042 | C04 | N05 | H051 | 156.9° | 120.0° |
| H121 | N12 | C13 | H131 | 65.1° | 120.0° |
| H121 | N12 | C13 | H132 | 175.1° | 120.0° |
| H151 | C15 | C16 | H161 | 0.4° | 0.0° |
| H181 | C18 | C19 | H191 | 0.3° | 0.1° |
| H251 | N25 | C26 | H261 | 145.8° | 145.0° |
| H261 | C26 | C27 | H271 | 170.9° | 180.0° |
| H261 | C26 | C27 | H272 | 52.0° | 60.0° |
| H261 | C26 | C32 | H321 | 52.5° | 60.0° |
| H261 | C26 | C32 | H322 | 171.6° | 179.9° |
| H271 | C27 | C28 | H281 | 52.4° | 59.9° |
| H271 | C27 | C28 | H282 | 171.7° | 180.0° |
| H272 | C27 | C28 | H281 | 66.6° | 60.0° |
| H272 | C27 | C28 | H282 | 52.7° | 60.1° |
| H281 | C28 | C29 | H291 | 55.1° | 60.0° |
| H282 | C28 | C29 | H291 | 174.4° | 180.0° |
| H291 | C29 | O30 | H301 | 61.0° | 59.9° |
| H291 | C29 | C31 | H311 | 55.9° | 60.0° |
| H291 | C29 | C31 | H312 | 175.2° | 180.0° |
| H311 | C31 | C32 | H321 | 65.3° | 60.0° |
| H311 | C31 | C32 | H322 | 53.9° | 60.0° |
| H312 | C31 | C32 | H321 | 54.0° | 59.9° |
| H312 | C31 | C32 | H322 | 173.2° | 180.0° |
