O101—C101 | 1.478 (8) | N201—H10 | 0.9500 |
O101—C105 | 1.351 (6) | C102—H1 | 0.9500 |
O102—C105 | 1.227 (6) | C102—H2 | 0.9500 |
O201—C202 | 1.211 (7) | C102—H3 | 0.9500 |
O301—C202 | 1.348 (7) | C103—H4 | 0.9501 |
O301—C301 | 1.429 (5) | C103—H5 | 0.9500 |
O302—C302 | 1.201 (7) | C103—H6 | 0.9500 |
O401—C302 | 1.326 (6) | C104—H7 | 0.9501 |
O401—C401 | 1.469 (7) | C104—H8 | 0.9500 |
N201—C105 | 1.353 (7) | C104—H9 | 0.9500 |
N201—C201 | 1.435 (7) | C201—H11 | 0.9500 |
C101—C102 | 1.513 (9) | C203—H12 | 0.9500 |
C101—C103 | 1.482 (9) | C203—H13 | 0.9499 |
C101—C104 | 1.491 (9) | C203—H14 | 0.9499 |
C201—C202 | 1.503 (6) | C301—H15 | 0.9500 |
C201—C203 | 1.546 (9) | C303—H16 | 0.9500 |
C301—C302 | 1.515 (8) | C303—H17 | 0.9500 |
C301—C303 | 1.522 (8) | C303—H18 | 0.9500 |
C401—C402 | 1.497 (7) | C401—H19 | 0.9500 |
C402—C403 | 1.381 (8) | C401—H20 | 0.9500 |
C402—C407 | 1.387 (8) | C403—H21 | 0.9500 |
C403—C404 | 1.377 (7) | C404—H22 | 0.9500 |
C404—C405 | 1.389 (8) | C405—H23 | 0.9500 |
C405—C406 | 1.371 (9) | C406—H24 | 0.9500 |
C406—C407 | 1.378 (8) | C407—H25 | 0.9501 |
| | | |
O101—C101—C102 | 108.2 (5) | C101—C103—H5 | 110.8126 |
O101—C101—C103 | 112.4 (6) | C101—C103—H6 | 107.7609 |
O101—C101—C104 | 102.0 (5) | C101—C104—H7 | 107.3647 |
C105—O101—C101 | 120.0 (4) | C101—C104—H8 | 110.6768 |
O101—C105—O102 | 126.4 (5) | C101—C104—H9 | 110.3492 |
O101—C105—N201 | 110.2 (4) | H2—C102—H1 | 109.4672 |
O102—C105—N201 | 123.4 (5) | H3—C102—H1 | 109.4743 |
O201—C202—C201 | 125.9 (5) | H3—C102—H2 | 109.4727 |
O201—C202—O301 | 122.9 (4) | H5—C103—H4 | 109.4706 |
O301—C202—C201 | 111.2 (4) | H6—C103—H4 | 109.4722 |
C301—O301—C202 | 116.9 (4) | H6—C103—H5 | 109.4734 |
O301—C301—C302 | 108.3 (4) | H8—C104—H7 | 109.4695 |
O301—C301—C303 | 107.5 (4) | H9—C104—H7 | 109.4710 |
O302—C302—C301 | 123.7 (4) | H9—C104—H8 | 109.4749 |
O302—C302—O401 | 124.6 (5) | H11—C201—C202 | 109.4716 |
O401—C302—C301 | 111.6 (4) | H11—C201—C203 | 109.1917 |
C401—O401—C302 | 114.4 (4) | C201—C203—H12 | 109.9418 |
O401—C401—C402 | 107.8 (5) | C201—C203—H14 | 109.3372 |
C201—N201—C105 | 119.3 (4) | C201—C203—H13 | 109.1277 |
N201—C201—C202 | 112.6 (4) | H14—C203—H12 | 109.4714 |
N201—C201—C203 | 109.1 (4) | H13—C203—H12 | 109.4752 |
C103—C101—C102 | 112.2 (6) | H14—C203—H13 | 109.4729 |
C104—C101—C102 | 109.9 (6) | H15—C301—C302 | 110.7004 |
C104—C101—C103 | 111.6 (6) | H15—C301—C303 | 109.4643 |
C203—C201—C202 | 107.8 (4) | C301—C303—H16 | 110.9877 |
C303—C301—C302 | 109.9 (5) | C301—C303—H17 | 110.1540 |
C401—C402—C403 | 121.3 (5) | C301—C303—H18 | 107.2433 |
C401—C402—C407 | 120.0 (5) | H17—C303—H16 | 109.4695 |
C407—C402—C403 | 118.6 (5) | H18—C303—H16 | 109.4721 |
C402—C403—C404 | 120.8 (5) | H18—C303—H17 | 109.4765 |
C402—C407—C406 | 120.6 (6) | H19—C401—C402 | 110.5426 |
C403—C404—C405 | 120.0 (6) | H20—C401—C402 | 109.9041 |
C404—C405—C406 | 119.4 (5) | H20—C401—H19 | 109.4604 |
C405—C406—C407 | 120.5 (6) | C402—C403—H21 | 119.3187 |
O301—C301—H15 | 110.9564 | C402—C407—H25 | 120.0817 |
O401—C401—H19 | 109.9480 | H21—C403—C404 | 119.8455 |
O401—C401—H20 | 109.1913 | C403—C404—H22 | 120.0760 |
H10—N201—C105 | 120.4366 | H22—C404—C405 | 119.8395 |
H10—N201—C201 | 120.2967 | C404—C405—H23 | 120.2310 |
N201—C201—H11 | 108.7045 | C405—C406—H24 | 119.0989 |
C101—C102—H1 | 108.8443 | H23—C405—C406 | 120.3234 |
C101—C102—H2 | 109.9174 | C406—C407—H25 | 119.2730 |
C101—C102—H3 | 109.6494 | H24—C406—C407 | 120.3841 |
| | | |
O101—C105—N201—C201 | 177.4 (4) | C(102)—C(101)—C(103)—H(5) | 179.4 |
C105—N201—C201—C202 | −66.9 (6) | C(102)—C(101)—C(103)—H(6) | −60.8 |
N201—C201—C202—O301 | 145.9 (5) | C(104)—C(101)—C(103)—H(4) | −65.5 |
C201—C202—O301—C301 | 166.4 (4) | C(104)—C(101)—C(103)—H(5) | 55.5 |
C202—O301—C301—C302 | −69.3 (5) | C(104)—C(101)—C(103)—H(6) | 175.3 |
O301—C301—C302—O401 | 162.7 (5) | O(101)—C(101)—C(104)—H(7) | −60.7 |
C301—C302—O401—C401 | 174.9 (4) | O(101)—C(101)—C(104)—H(8) | 58.7 |
C(105)—O(101)—C(101)—C(102) | 63.9 (7) | O(101)—C(101)—C(104)—H(9) | −180.0 |
C(105)—O(101)—C(101)—C(103) | −60.5 (6) | C(102)—C(101)—C(104)—H(7) | 53.9 |
C(105)—O(101)—C(101)—C(104) | 179.8 (4) | C(102)—C(101)—C(104)—H(8) | 173.3 |
C(101)—O(101)—C(105)—O(102) | 12.3 (7) | C(102)—C(101)—C(104)—H(9) | −65.3 |
C(101)—O(101)—C(105)—N(201) | −169.5 (4) | C(103)—C(101)—C(104)—H(7) | 179.0 |
C(301)—O(301)—C(202)—O(201) | −11.5 (8) | C(103)—C(101)—C(104)—H(8) | −61.6 |
C(202)—O(301)—C(301)—C(303) | 172.1 (4) | C(103)—C(101)—C(104)—H(9) | 59.8 |
C(401)—O(401)—C(302)—O(302) | −3.2 (8) | H(11)—C(201)—C(202)—O(201) | −157.3 |
C(302)—O(401)—C(401)—C(402) | −178.4 (4) | H(11)—C(201)—C(202)—O(301) | 24.8 |
C(201)—N(201)—C(105)—O(102) | −4.3 (7) | N(201)—C(201)—C(203)—H(12) | −178.0 |
C(105)—N(201)—C(201)—C(203) | 173.5 (4) | N(201)—C(201)—C(203)—H(13) | −57.9 |
N(201)—C(201)—C(202)—O(201) | −36.3 (8) | N(201)—C(201)—C(203)—H(14) | 61.8 |
C(203)—C(201)—C(202)—O(201) | 84.1 (7) | C(202)—C(201)—C(203)—H(12) | 59.4 |
C(203)—C(201)—C(202)—O(301) | −93.8 (5) | C(202)—C(201)—C(203)—H(13) | 179.5 |
O(301)—C(301)—C(302)—O(302) | −19.1 (8) | C(202)—C(201)—C(203)—H(14) | −60.8 |
C(303)—C(301)—C(302)—O(302) | 98.0 (6) | H(11)—C(201)—C(203)—H(12) | −59.4 |
C(303)—C(301)—C(302)—O(401) | −80.2 (5) | H(11)—C(201)—C(203)—H(13) | 60.7 |
O(401)—C(401)—C(402)—C(403) | −115.6 (6) | H(11)—C(201)—C(203)—H(14) | −179.6 |
O(401)—C(401)—C(402)—C(407) | 68.0 (8) | H(15)—C(301)—C(302)—O(302) | −141.0 |
C(401)—C(402)—C(403)—C(404) | −177.6 (5) | H(15)—C(301)—C(302)—O(401) | 40.8 |
C(407)—C(402)—C(403)—C(404) | −1.2 (8) | O(301)—C(301)—C(303)—H(16) | 178.9 |
C(401)—C(402)—C(407)—C(406) | 177.7 (6) | O(301)—C(301)—C(303)—H(17) | −59.7 |
C(403)—C(402)—C(407)—C(406) | 1.2 (9) | O(301)—C(301)—C(303)—H(18) | 59.4 |
C(402)—C(403)—C(404)—C(405) | −0.6 (9) | C(302)—C(301)—C(303)—H(16) | 61.3 |
C(403)—C(404)—C(405)—C(406) | 2.3 (9) | C(302)—C(301)—C(303)—H(17) | −177.3 |
C(404)—C(405)—C(406)—C(407) | −2.3 (9) | C(302)—C(301)—C(303)—H(18) | −58.3 |
C(405)—C(406)—C(407)—C(402) | 0.5 (9) | H(15)—C(301)—C(303)—H(16) | −60.5 |
C(202)—O(301)—C(301)—H(15) | 52.4 | H(15)—C(301)—C(303)—H(17) | 60.9 |
C(302)—O(401)—C(401)—H(19) | −57.9 | H(15)—C(301)—C(303)—H(18) | 180.0 |
C(302)—O(401)—C(401)—H(20) | 62.2 | H(19)—C(401)—C(402)—C(403) | 124.2 |
H(10)—N(201)—C(105)—O(101) | −2.3 | H(19)—C(401)—C(402)—C(407) | −52.2 |
H(10)—N(201)—C(105)—O(102) | 176.0 | H(20)—C(401)—C(402)—C(403) | 3.3 |
C(105)—N(201)—C(201)—H(11) | 54.6 | H(20)—C(401)—C(402)—C(407) | −173.1 |
H(10)—N(201)—C(201)—C(202) | 112.8 | C(401)—C(402)—C(403)—H(21) | 1.0 |
H(10)—N(201)—C(201)—C(203) | −6.8 | C(407)—C(402)—C(403)—H(21) | 177.4 |
H(10)—N(201)—C(201)—H(11) | −125.7 | C(401)—C(402)—C(407)—H(25) | −4.6 |
O(101)—C(101)—C(102)—H(1) | 58.8 | C(403)—C(402)—C(407)—H(25) | 178.9 |
O(101)—C(101)—C(102)—H(2) | 178.7 | C(402)—C(403)—C(404)—H(22) | −178.0 |
O(101)—C(101)—C(102)—H(3) | −61.0 | H(21)—C(403)—C(404)—C(405) | −179.1 |
C(103)—C(101)—C(102)—H(1) | −176.6 | H(21)—C(403)—C(404)—H(22) | 3.5 |
C(103)—C(101)—C(102)—H(2) | −56.8 | C(403)—C(404)—C(405)—H(23) | 178.9 |
C(103)—C(101)—C(102)—H(3) | 63.6 | H(22)—C(404)—C(405)—C(406) | 179.7 |
C(104)—C(101)—C(102)—H(1) | −51.8 | H(22)—C(404)—C(405)—H(23) | −3.7 |
C(104)—C(101)—C(102)—H(2) | 68.0 | C(404)—C(405)—C(406)—H(24) | 179.0 |
C(104)—C(101)—C(102)—H(3) | −171.6 | H(23)—C(405)—C(406)—C(407) | −178.9 |
O(101)—C(101)—C(103)—H(4) | −179.5 | H(23)—C(405)—C(406)—H(24) | 2.4 |
O(101)—C(101)—C(103)—H(5) | −58.4 | C(405)—C(406)—C(407)—H(25) | −177.1 |
O(101)—C(101)—C(103)—H(6) | 61.3 | H(24)—C(406)—C(407)—C(402) | 179.2 |
C(102)—C(101)—C(103)—H(4) | 58.3 | H(24)—C(406)—C(407)—H(25) | 1.5 |