8KC
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C33 | C34 | doub | 1.38Å | 1.39Å | Aromatic |
| C33 | C32 | sing | 1.38Å | 1.39Å | Aromatic |
| C34 | C29 | sing | 1.38Å | 1.40Å | Aromatic |
| C18 | C19 | sing | 1.53Å | 1.55Å | |
| C18 | C17 | sing | 1.53Å | 1.51Å | |
| C32 | C31 | doub | 1.38Å | 1.40Å | Aromatic |
| C19 | C20 | sing | 1.53Å | 1.54Å | |
| N22 | C17 | sing | 1.47Å | 1.48Å | |
| N22 | C23 | sing | 1.47Å | 1.48Å | |
| C27 | C23 | sing | 1.53Å | 1.57Å | |
| C27 | C28 | sing | 1.53Å | 1.56Å | |
| C20 | C21 | sing | 1.53Å | 1.59Å | |
| O25 | C24 | doub | 1.21Å | 1.25Å | |
| C17 | C16 | sing | 1.51Å | 1.53Å | |
| C29 | C28 | sing | 1.51Å | 1.58Å | |
| C29 | C30 | doub | 1.38Å | 1.39Å | Aromatic |
| C23 | C24 | sing | 1.51Å | 1.49Å | |
| C31 | C30 | sing | 1.38Å | 1.39Å | Aromatic |
| C24 | O26 | sing | 1.34Å | 1.25Å | |
| C16 | O35 | doub | 1.21Å | 1.19Å | |
| C16 | N15 | sing | 1.35Å | 1.48Å | |
| O01 | C02 | doub | 1.21Å | 1.26Å | |
| N15 | C04 | sing | 1.46Å | 1.46Å | |
| C02 | O03 | sing | 1.34Å | 1.27Å | |
| C02 | C04 | sing | 1.51Å | 1.51Å | |
| C13 | C14 | doub | 1.38Å | 1.39Å | Aromatic |
| C13 | C12 | sing | 1.39Å | 1.39Å | Aromatic |
| C14 | C09 | sing | 1.39Å | 1.41Å | Aromatic |
| C12 | C11 | doub | 1.37Å | 1.40Å | Aromatic |
| C09 | N08 | sing | 1.38Å | 1.34Å | Aromatic |
| C09 | C10 | doub | 1.41Å | 1.38Å | Aromatic |
| C04 | C05 | sing | 1.53Å | 1.55Å | |
| N08 | C07 | sing | 1.37Å | 1.32Å | Aromatic |
| C11 | C10 | sing | 1.40Å | 1.40Å | Aromatic |
| C10 | C06 | sing | 1.47Å | 1.41Å | Aromatic |
| C07 | C06 | doub | 1.34Å | 1.40Å | Aromatic |
| C06 | C05 | sing | 1.51Å | 1.57Å | |
| C21 | H211 | sing | 1.09Å | 1.10Å | |
| C21 | H213 | sing | 1.09Å | 1.10Å | |
| C21 | H212 | sing | 1.09Å | 1.10Å | |
| C20 | H202 | sing | 1.09Å | 1.10Å | |
| C20 | H201 | sing | 1.09Å | 1.10Å | |
| C19 | H192 | sing | 1.09Å | 1.10Å | |
| C19 | H191 | sing | 1.09Å | 1.10Å | |
| C18 | H182 | sing | 1.09Å | 1.10Å | |
| C18 | H181 | sing | 1.09Å | 1.10Å | |
| C17 | H171 | sing | 1.09Å | 1.10Å | |
| C11 | H111 | sing | 1.08Å | 1.08Å | |
| C12 | H121 | sing | 1.08Å | 1.08Å | |
| C13 | H131 | sing | 1.08Å | 1.08Å | |
| C14 | H141 | sing | 1.08Å | 1.08Å | |
| C27 | H272 | sing | 1.09Å | 1.10Å | |
| C27 | H271 | sing | 1.09Å | 1.10Å | |
| C28 | H282 | sing | 1.09Å | 1.10Å | |
| C28 | H281 | sing | 1.09Å | 1.10Å | |
| C30 | H301 | sing | 1.08Å | 1.08Å | |
| C31 | H311 | sing | 1.08Å | 1.08Å | |
| C04 | H041 | sing | 1.09Å | 1.10Å | |
| C05 | H051 | sing | 1.09Å | 1.10Å | |
| C05 | H052 | sing | 1.09Å | 1.10Å | |
| C07 | H071 | sing | 1.08Å | 1.08Å | |
| C23 | H231 | sing | 1.09Å | 1.10Å | |
| C32 | H321 | sing | 1.08Å | 1.08Å | |
| C33 | H331 | sing | 1.08Å | 1.08Å | |
| C34 | H341 | sing | 1.08Å | 1.08Å | |
| N08 | H081 | sing | 0.97Å | 1.00Å | |
| N15 | H151 | sing | 0.97Å | 1.00Å | |
| N22 | H221 | sing | 1.01Å | 1.00Å | |
| O03 | H2 | sing | 0.97Å | 0.95Å | |
| O26 | H3 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C34 | C33 | C32 | 120.0° | 120.0° |
| C33 | C34 | C29 | 120.0° | 120.0° |
| C34 | C33 | H331 | 120.0° | 120.0° |
| C33 | C34 | H341 | 120.0° | 120.0° |
| C33 | C32 | C31 | 119.9° | 120.0° |
| C33 | C32 | H321 | 120.0° | 120.0° |
| C32 | C33 | H331 | 120.0° | 120.0° |
| C34 | C29 | C28 | 121.1° | 120.0° |
| C34 | C29 | C30 | 119.8° | 120.0° |
| C29 | C34 | H341 | 120.0° | 120.0° |
| C19 | C18 | C17 | 113.7° | 109.5° |
| C18 | C19 | C20 | 113.2° | 109.5° |
| C18 | C19 | H192 | 108.6° | 109.5° |
| C18 | C19 | H191 | 108.5° | 109.5° |
| C19 | C18 | H182 | 108.4° | 109.5° |
| C19 | C18 | H181 | 108.4° | 109.4° |
| C18 | C17 | N22 | 108.5° | 109.5° |
| C18 | C17 | C16 | 110.5° | 109.5° |
| C17 | C18 | H182 | 108.4° | 109.5° |
| C17 | C18 | H181 | 108.4° | 109.5° |
| C18 | C17 | H171 | 109.3° | 109.5° |
| C32 | C31 | C30 | 120.1° | 120.0° |
| C32 | C31 | H311 | 120.0° | 120.0° |
| C31 | C32 | H321 | 120.1° | 120.0° |
| C19 | C20 | C21 | 112.1° | 109.5° |
| C19 | C20 | H202 | 108.8° | 109.5° |
| C19 | C20 | H201 | 108.8° | 109.5° |
| C20 | C19 | H192 | 108.6° | 109.4° |
| C20 | C19 | H191 | 108.5° | 109.5° |
| C17 | N22 | C23 | 112.7° | 111.0° |
| N22 | C17 | C16 | 109.6° | 109.5° |
| N22 | C17 | H171 | 109.8° | 109.4° |
| C17 | N22 | H221 | 108.6° | 111.0° |
| N22 | C23 | C27 | 109.3° | 109.5° |
| N22 | C23 | C24 | 109.8° | 109.4° |
| N22 | C23 | H231 | 109.6° | 109.5° |
| C23 | N22 | H221 | 108.7° | 111.0° |
| C23 | C27 | C28 | 111.4° | 109.5° |
| C27 | C23 | C24 | 110.3° | 109.5° |
| C23 | C27 | H272 | 109.0° | 109.5° |
| C23 | C27 | H271 | 109.0° | 109.5° |
| C27 | C23 | H231 | 108.4° | 109.5° |
| C27 | C28 | C29 | 115.6° | 109.5° |
| C28 | C27 | H272 | 109.0° | 109.5° |
| C28 | C27 | H271 | 109.0° | 109.5° |
| C27 | C28 | H282 | 107.9° | 109.5° |
| C27 | C28 | H281 | 107.9° | 109.4° |
| C20 | C21 | H211 | 109.5° | 109.5° |
| C20 | C21 | H213 | 109.5° | 109.5° |
| C20 | C21 | H212 | 109.5° | 109.5° |
| C21 | C20 | H202 | 108.8° | 109.5° |
| C21 | C20 | H201 | 108.8° | 109.5° |
| O25 | C24 | C23 | 120.3° | 120.0° |
| O25 | C24 | O26 | 120.1° | 120.0° |
| C17 | C16 | O35 | 119.2° | 120.0° |
| C17 | C16 | N15 | 120.5° | 120.0° |
| C16 | C17 | H171 | 109.1° | 109.5° |
| C28 | C29 | C30 | 119.1° | 120.0° |
| C29 | C28 | H282 | 107.9° | 109.5° |
| C29 | C28 | H281 | 107.9° | 109.4° |
| C29 | C30 | C31 | 120.1° | 120.0° |
| C29 | C30 | H301 | 119.9° | 120.0° |
| C23 | C24 | O26 | 119.6° | 120.0° |
| C24 | C23 | H231 | 109.4° | 109.5° |
| C31 | C30 | H301 | 119.9° | 120.0° |
| C30 | C31 | H311 | 119.9° | 120.0° |
| C24 | O26 | H3 | 109.5° | 117.0° |
| O35 | C16 | N15 | 120.3° | 119.9° |
| C16 | N15 | C04 | 118.8° | 120.0° |
| C16 | N15 | H151 | 120.6° | 119.9° |
| O01 | C02 | O03 | 120.0° | 120.0° |
| O01 | C02 | C04 | 119.7° | 120.0° |
| N15 | C04 | C02 | 107.2° | 109.4° |
| N15 | C04 | C05 | 112.8° | 109.4° |
| N15 | C04 | H041 | 109.1° | 109.5° |
| C04 | N15 | H151 | 120.6° | 120.1° |
| O03 | C02 | C04 | 120.3° | 120.0° |
| C02 | O03 | H2 | 109.5° | 117.0° |
| C02 | C04 | C05 | 111.5° | 109.4° |
| C02 | C04 | H041 | 108.4° | 109.5° |
| C14 | C13 | C12 | 120.1° | 120.6° |
| C13 | C14 | C09 | 119.8° | 119.8° |
| C14 | C13 | H131 | 120.0° | 119.7° |
| C13 | C14 | H141 | 120.1° | 120.1° |
| C13 | C12 | C11 | 120.0° | 120.5° |
| C13 | C12 | H121 | 120.0° | 119.7° |
| C12 | C13 | H131 | 120.0° | 119.7° |
| C14 | C09 | N08 | 131.6° | 133.5° |
| C14 | C09 | C10 | 120.0° | 119.3° |
| C09 | C14 | H141 | 120.1° | 120.1° |
| C12 | C11 | C10 | 119.9° | 119.8° |
| C12 | C11 | H111 | 120.0° | 120.1° |
| C11 | C12 | H121 | 120.0° | 119.7° |
| N08 | C09 | C10 | 108.3° | 107.2° |
| C09 | N08 | C07 | 110.3° | 109.9° |
| C09 | N08 | H081 | 124.9° | 125.1° |
| C09 | C10 | C11 | 120.2° | 119.9° |
| C09 | C10 | C06 | 106.9° | 106.0° |
| C04 | C05 | C06 | 118.1° | 109.4° |
| C05 | C04 | H041 | 107.8° | 109.5° |
| C04 | C05 | H051 | 107.3° | 109.5° |
| C04 | C05 | H052 | 107.2° | 109.4° |
| N08 | C07 | C06 | 108.7° | 110.0° |
| N08 | C07 | H071 | 125.7° | 125.0° |
| C07 | N08 | H081 | 124.8° | 125.1° |
| C11 | C10 | C06 | 132.9° | 134.1° |
| C10 | C11 | H111 | 120.0° | 120.1° |
| C10 | C06 | C07 | 105.8° | 107.0° |
| C10 | C06 | C05 | 126.3° | 126.5° |
| C07 | C06 | C05 | 127.9° | 126.5° |
| C06 | C07 | H071 | 125.6° | 125.0° |
| C06 | C05 | H051 | 107.3° | 109.5° |
| C06 | C05 | H052 | 107.3° | 109.5° |
| H211 | C21 | H213 | 109.5° | 109.5° |
| H211 | C21 | H212 | 109.4° | 109.4° |
| H213 | C21 | H212 | 109.5° | 109.4° |
| H202 | C20 | H201 | 109.4° | 109.5° |
| H192 | C19 | H191 | 109.5° | 109.5° |
| H182 | C18 | H181 | 109.5° | 109.5° |
| H272 | C27 | H271 | 109.5° | 109.4° |
| H282 | C28 | H281 | 109.5° | 109.5° |
| H051 | C05 | H052 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C34 | C33 | C32 | H331 | 180.0° | 179.4° |
| C33 | C34 | C29 | H341 | 180.0° | 179.4° |
| C34 | C33 | C32 | C31 | 0.2° | 0.3° |
| C33 | C34 | C29 | C28 | 179.5° | 179.7° |
| C33 | C34 | C29 | C30 | 0.7° | 0.6° |
| C34 | C33 | C32 | H321 | 179.8° | 179.7° |
| C32 | C33 | C34 | C29 | 0.4° | 0.6° |
| C33 | C32 | C31 | H321 | 180.0° | 180.0° |
| C33 | C32 | C31 | C30 | 0.2° | 0.0° |
| C33 | C32 | C31 | H311 | 179.8° | 180.0° |
| C32 | C33 | C34 | H341 | 179.5° | 180.0° |
| C34 | C29 | C28 | C27 | 50.2° | 90.2° |
| C34 | C29 | C28 | C30 | 178.9° | 179.7° |
| C34 | C29 | C30 | C31 | 0.7° | 0.3° |
| C34 | C29 | C28 | H282 | 171.1° | 149.8° |
| C34 | C29 | C28 | H281 | 70.7° | 29.7° |
| C34 | C29 | C30 | H301 | 179.3° | 179.8° |
| C29 | C34 | C33 | H331 | 179.6° | 180.0° |
| C19 | C18 | C17 | H182 | 120.6° | 120.0° |
| C19 | C18 | C17 | H181 | 120.6° | 120.0° |
| C18 | C19 | C20 | H192 | 120.6° | 120.0° |
| C18 | C19 | C20 | H191 | 120.5° | 120.0° |
| C19 | C18 | C17 | N22 | 179.7° | 62.9° |
| C18 | C19 | C20 | C21 | 175.6° | NaN° |
| C19 | C18 | C17 | C16 | 59.5° | 177.1° |
| C18 | C19 | C20 | H202 | 64.0° | 60.0° |
| C18 | C19 | C20 | H201 | 55.2° | 60.0° |
| C18 | C19 | H192 | H191 | 118.3° | 120.0° |
| C19 | C18 | H182 | H181 | 118.1° | 120.0° |
| C19 | C18 | C17 | H171 | 60.6° | 57.1° |
| C17 | C18 | C19 | C20 | 67.2° | 177.0° |
| C18 | C17 | N22 | C16 | 120.7° | 120.1° |
| C18 | C17 | N22 | H171 | 119.4° | 120.0° |
| C18 | C17 | N22 | C23 | 172.2° | 155.1° |
| C18 | C17 | C16 | H171 | 120.2° | 120.0° |
| C18 | C17 | C16 | O35 | 98.2° | 120.0° |
| C18 | C17 | C16 | N15 | 82.2° | 59.9° |
| C17 | C18 | C19 | H192 | 172.2° | 57.0° |
| C17 | C18 | C19 | H191 | 53.3° | 63.0° |
| C17 | C18 | H182 | H181 | 118.1° | 120.0° |
| C18 | C17 | N22 | H221 | 67.3° | 80.9° |
| C32 | C31 | C30 | C29 | 0.5° | 0.0° |
| C32 | C31 | C30 | H311 | 180.0° | 180.0° |
| C32 | C31 | C30 | H301 | 179.5° | 179.9° |
| C31 | C32 | C33 | H331 | 179.8° | 179.7° |
| C19 | C20 | C21 | H202 | 120.4° | 120.0° |
| C19 | C20 | C21 | H201 | 120.4° | 120.0° |
| C19 | C20 | C21 | H211 | 180.0° | 60.0° |
| C19 | C20 | C21 | H213 | 60.0° | 180.0° |
| C19 | C20 | C21 | H212 | 60.0° | 60.0° |
| C19 | C20 | H202 | H201 | 118.8° | 120.0° |
| C20 | C19 | H192 | H191 | 118.3° | 120.0° |
| C20 | C19 | C18 | H182 | 172.1° | 62.9° |
| C20 | C19 | C18 | H181 | 53.4° | 57.0° |
| C17 | N22 | C23 | H221 | 120.5° | 123.9° |
| C17 | N22 | C23 | C27 | 179.5° | 156.4° |
| N22 | C17 | C16 | H171 | 120.3° | 119.9° |
| C17 | N22 | C23 | C24 | 58.4° | 83.5° |
| N22 | C17 | C16 | O35 | 21.3° | 0.0° |
| N22 | C17 | C16 | N15 | 158.3° | 180.0° |
| N22 | C17 | C18 | H182 | 59.1° | 177.1° |
| N22 | C17 | C18 | H181 | 59.7° | 57.1° |
| C17 | N22 | C23 | H231 | 61.8° | 36.4° |
| N22 | C23 | C27 | C24 | 120.8° | 120.0° |
| N22 | C23 | C27 | H231 | 119.5° | 120.0° |
| N22 | C23 | C27 | C28 | 139.6° | 65.0° |
| N22 | C23 | C24 | O25 | 46.7° | 27.0° |
| C23 | N22 | C17 | C16 | 67.0° | 84.8° |
| N22 | C23 | C24 | H231 | 120.3° | 120.0° |
| N22 | C23 | C24 | O26 | 132.4° | 153.0° |
| C23 | N22 | C17 | H171 | 52.8° | 35.1° |
| N22 | C23 | C27 | H272 | 19.3° | 175.0° |
| N22 | C23 | C27 | H271 | 100.2° | 55.1° |
| C23 | C27 | C28 | H272 | 120.3° | 120.0° |
| C23 | C27 | C28 | H271 | 120.3° | 120.0° |
| C27 | C23 | C24 | O25 | 73.8° | 93.0° |
| C23 | C27 | C28 | C29 | 169.3° | 180.0° |
| C27 | C23 | C24 | H231 | 119.2° | 120.0° |
| C27 | C23 | C24 | O26 | 107.1° | 87.0° |
| C23 | C27 | H272 | H271 | 119.1° | 119.9° |
| C23 | C27 | C28 | H282 | 48.4° | 60.0° |
| C23 | C27 | C28 | H281 | 69.9° | 60.0° |
| C27 | C23 | N22 | H221 | 60.1° | 32.5° |
| C27 | C28 | C29 | H282 | 120.9° | 120.0° |
| C27 | C28 | C29 | H281 | 120.9° | 119.9° |
| C27 | C28 | C29 | C30 | 131.0° | 90.0° |
| C28 | C27 | C23 | C24 | 99.7° | 175.0° |
| C28 | C27 | H272 | H271 | 119.1° | 120.0° |
| C27 | C28 | H282 | H281 | 117.3° | 120.0° |
| C28 | C27 | C23 | H231 | 20.1° | 55.0° |
| C20 | C21 | H211 | H213 | 120.0° | 120.1° |
| C20 | C21 | H211 | H212 | 120.0° | 120.0° |
| C20 | C21 | H213 | H212 | 120.0° | 120.0° |
| C21 | C20 | H202 | H201 | 118.8° | 120.0° |
| C21 | C20 | C19 | H192 | 55.0° | 60.0° |
| C21 | C20 | C19 | H191 | 63.9° | 60.0° |
| O25 | C24 | C23 | O26 | 179.1° | 180.0° |
| O25 | C24 | C23 | H231 | 167.0° | 147.0° |
| O25 | C24 | O26 | H3 | 0.0° | 0.0° |
| C17 | C16 | O35 | N15 | 179.6° | 180.0° |
| C17 | C16 | N15 | C04 | 179.8° | 180.0° |
| C16 | C17 | C18 | H182 | 61.1° | 57.0° |
| C16 | C17 | C18 | H181 | 179.9° | 63.0° |
| C17 | C16 | N15 | H151 | 0.2° | 0.1° |
| C16 | C17 | N22 | H221 | 53.4° | 39.1° |
| C28 | C29 | C30 | C31 | 179.6° | 180.0° |
| C29 | C28 | C27 | H272 | 70.5° | 60.0° |
| C29 | C28 | C27 | H271 | 49.0° | 59.9° |
| C29 | C28 | H282 | H281 | 117.2° | 120.0° |
| C28 | C29 | C30 | H301 | 0.5° | 0.0° |
| C28 | C29 | C34 | H341 | 0.4° | 0.3° |
| C29 | C30 | C31 | H301 | 180.0° | 179.9° |
| C30 | C29 | C28 | H282 | 10.1° | 30.0° |
| C30 | C29 | C28 | H281 | 108.1° | 150.0° |
| C29 | C30 | C31 | H311 | 179.5° | 180.0° |
| C30 | C29 | C34 | H341 | 179.3° | 180.0° |
| C24 | C23 | C27 | H272 | 140.0° | 55.0° |
| C24 | C23 | C27 | H271 | 20.6° | 64.9° |
| C24 | C23 | N22 | H221 | 178.9° | 152.5° |
| C23 | C24 | O26 | H3 | 179.1° | 180.0° |
| C30 | C31 | C32 | H321 | 179.8° | 180.0° |
| O26 | C24 | C23 | H231 | 12.0° | 33.0° |
| O35 | C16 | N15 | C04 | 0.6° | 0.0° |
| O35 | C16 | C17 | H171 | 141.5° | 120.0° |
| O35 | C16 | N15 | H151 | 179.4° | 180.0° |
| C16 | N15 | C04 | H151 | 180.0° | 179.9° |
| C16 | N15 | C04 | C02 | 60.4° | 85.1° |
| C16 | N15 | C04 | C05 | 176.6° | 155.0° |
| N15 | C16 | C17 | H171 | 38.1° | 60.1° |
| C16 | N15 | C04 | H041 | 56.8° | 35.0° |
| O01 | C02 | C04 | N15 | 25.9° | 0.1° |
| O01 | C02 | O03 | C04 | 178.9° | 179.9° |
| O01 | C02 | C04 | C05 | 98.0° | 120.0° |
| O01 | C02 | C04 | H041 | 143.5° | 120.0° |
| O01 | C02 | O03 | H2 | 0.0° | 0.1° |
| N15 | C04 | C02 | O03 | 153.0° | 180.0° |
| N15 | C04 | C02 | C05 | 123.8° | 119.9° |
| N15 | C04 | C02 | H041 | 117.6° | 120.1° |
| N15 | C04 | C05 | H041 | 120.5° | 120.0° |
| N15 | C04 | C05 | C06 | 32.3° | 65.1° |
| N15 | C04 | C05 | H051 | 153.5° | 54.9° |
| N15 | C04 | C05 | H052 | 88.9° | 175.0° |
| O03 | C02 | C04 | C05 | 83.1° | 60.1° |
| O03 | C02 | C04 | H041 | 35.4° | 59.9° |
| C02 | C04 | C05 | H041 | 118.9° | 120.1° |
| C02 | C04 | C05 | C06 | 88.3° | 175.0° |
| C02 | C04 | C05 | H051 | 33.0° | 65.0° |
| C02 | C04 | C05 | H052 | 150.5° | 55.1° |
| C02 | C04 | N15 | H151 | 119.6° | 95.0° |
| C04 | C02 | O03 | H2 | 178.9° | 180.0° |
| C14 | C13 | C12 | H131 | 180.0° | 179.8° |
| C13 | C14 | C09 | H141 | 180.0° | 179.8° |
| C14 | C13 | C12 | C11 | 0.1° | 0.1° |
| C13 | C14 | C09 | N08 | 179.9° | 179.5° |
| C13 | C14 | C09 | C10 | 0.0° | 0.6° |
| C14 | C13 | C12 | H121 | 180.0° | 180.0° |
| C12 | C13 | C14 | C09 | 0.0° | 0.3° |
| C13 | C12 | C11 | H121 | 180.0° | 179.9° |
| C13 | C12 | C11 | C10 | 0.1° | 0.1° |
| C13 | C12 | C11 | H111 | 180.0° | 180.0° |
| C12 | C13 | C14 | H141 | 179.9° | 180.0° |
| C14 | C09 | N08 | C10 | 179.9° | 179.0° |
| C14 | C09 | N08 | C07 | 180.0° | 179.5° |
| C14 | C09 | C10 | C11 | 0.0° | 0.6° |
| C14 | C09 | C10 | C06 | 179.4° | 179.6° |
| C09 | C14 | C13 | H131 | 180.0° | 180.0° |
| C14 | C09 | N08 | H081 | 0.0° | 0.0° |
| C12 | C11 | C10 | C09 | 0.1° | 0.3° |
| C12 | C11 | C10 | H111 | 180.0° | 179.9° |
| C12 | C11 | C10 | C06 | 179.2° | 179.9° |
| C11 | C12 | C13 | H131 | 180.0° | 179.7° |
| C09 | N08 | C07 | H081 | 180.0° | 179.6° |
| N08 | C09 | C10 | C11 | 180.0° | 179.8° |
| N08 | C09 | C10 | C06 | 0.5° | 0.5° |
| C09 | N08 | C07 | C06 | 0.7° | 0.3° |
| N08 | C09 | C14 | H141 | 0.1° | 0.7° |
| C09 | N08 | C07 | H071 | 179.3° | 179.7° |
| C10 | C09 | N08 | C07 | 0.1° | 0.5° |
| C09 | C10 | C11 | C06 | 179.3° | 179.7° |
| C09 | C10 | C06 | C07 | 0.9° | 0.3° |
| C09 | C10 | C06 | C05 | 178.9° | 179.7° |
| C09 | C10 | C11 | H111 | 180.0° | 179.7° |
| C10 | C09 | C14 | H141 | 179.9° | 179.6° |
| C10 | C09 | N08 | H081 | 179.9° | 179.1° |
| C04 | C05 | C06 | C10 | 94.8° | 85.0° |
| C04 | C05 | C06 | C07 | 87.5° | 95.0° |
| C04 | C05 | C06 | H051 | 121.2° | 120.0° |
| C04 | C05 | C06 | H052 | 121.2° | 119.9° |
| C04 | C05 | H051 | H052 | 116.1° | 120.0° |
| C05 | C04 | N15 | H151 | 3.4° | 24.9° |
| N08 | C07 | C06 | C10 | 0.9° | 0.0° |
| N08 | C07 | C06 | H071 | 180.0° | 180.0° |
| N08 | C07 | C06 | C05 | 178.9° | 180.0° |
| C11 | C10 | C06 | C07 | 179.8° | 180.0° |
| C11 | C10 | C06 | C05 | 1.7° | 0.0° |
| C10 | C11 | C12 | H121 | 180.0° | 180.0° |
| C10 | C06 | C07 | C05 | 178.0° | 180.0° |
| C06 | C10 | C11 | H111 | 0.7° | 0.0° |
| C10 | C06 | C05 | H051 | 26.4° | 35.0° |
| C10 | C06 | C05 | H052 | 143.9° | 155.0° |
| C10 | C06 | C07 | H071 | 179.1° | 180.0° |
| C07 | C06 | C05 | H051 | 151.2° | 145.0° |
| C07 | C06 | C05 | H052 | 33.7° | 24.9° |
| C06 | C07 | N08 | H081 | 179.4° | 179.2° |
| C06 | C05 | C04 | H041 | 152.8° | 55.0° |
| C06 | C05 | H051 | H052 | 116.1° | 120.0° |
| C05 | C06 | C07 | H071 | 1.1° | 0.0° |
| H211 | C21 | H213 | H212 | 120.0° | 120.0° |
| H211 | C21 | C20 | H202 | 59.6° | 179.9° |
| H211 | C21 | C20 | H201 | 59.6° | 60.0° |
| H213 | C21 | C20 | H202 | 179.6° | 60.0° |
| H213 | C21 | C20 | H201 | 60.4° | 60.0° |
| H212 | C21 | C20 | H202 | 60.4° | 60.0° |
| H212 | C21 | C20 | H201 | 179.6° | 180.0° |
| H202 | C20 | C19 | H192 | 175.4° | 180.0° |
| H202 | C20 | C19 | H191 | 56.5° | 60.0° |
| H201 | C20 | C19 | H192 | 65.4° | 60.0° |
| H201 | C20 | C19 | H191 | 175.7° | 180.0° |
| H192 | C19 | C18 | H182 | 51.6° | 177.1° |
| H192 | C19 | C18 | H181 | 67.2° | 63.0° |
| H191 | C19 | C18 | H182 | 67.3° | 57.0° |
| H191 | C19 | C18 | H181 | 173.9° | 177.0° |
| H182 | C18 | C17 | H171 | 178.8° | 63.0° |
| H181 | C18 | C17 | H171 | 60.0° | 177.0° |
| H171 | C17 | N22 | H221 | 173.3° | 159.1° |
| H111 | C11 | C12 | H121 | 0.0° | 0.1° |
| H121 | C12 | C13 | H131 | 0.0° | 0.3° |
| H131 | C13 | C14 | H141 | 0.0° | 0.2° |
| H272 | C27 | C28 | H282 | 168.7° | 60.0° |
| H272 | C27 | C28 | H281 | 50.4° | 179.9° |
| H272 | C27 | C23 | H231 | 100.2° | 65.1° |
| H271 | C27 | C28 | H282 | 71.9° | 180.0° |
| H271 | C27 | C28 | H281 | 169.9° | 60.0° |
| H271 | C27 | C23 | H231 | 140.4° | 175.1° |
| H301 | C30 | C31 | H311 | 0.5° | 0.1° |
| H311 | C31 | C32 | H321 | 0.2° | 0.0° |
| H041 | C04 | C05 | H051 | 86.0° | 175.0° |
| H041 | C04 | C05 | H052 | 31.6° | 65.0° |
| H041 | C04 | N15 | H151 | 123.2° | 145.0° |
| H071 | C07 | N08 | H081 | 0.6° | 0.8° |
| H231 | C23 | N22 | H221 | 58.6° | 87.5° |
| H321 | C32 | C33 | H331 | 0.2° | 0.3° |
| H331 | C33 | C34 | H341 | 0.5° | 0.6° |
