| 5SB2_1K2_A_1006 |
| RDKit 3D |
|
|
| 50 54 0 0 0 0 0 0 0 0999 V2000 |
| -6.6733 0.2540 -0.8851 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -1.1752 -0.5045 0.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -1.3608 -1.2256 -0.3976 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| 0.0010 -0.7402 1.4569 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 1.0916 -0.7024 3.6056 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 2.2431 -1.2584 3.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 2.2885 -1.5623 1.6784 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 3.5217 -2.2010 1.0794 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 4.5154 -0.5637 -0.3756 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 4.9070 0.2972 0.6502 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 5.6304 1.4529 0.2985 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 5.9039 1.6565 -1.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 6.7937 3.3802 0.0741 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 6.1959 2.5519 1.0021 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 4.8576 -0.2230 -1.6856 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -1.9875 0.5610 0.9182 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| -3.1315 0.9104 0.1321 C 0 0 1 0 0 0 0 0 0 0 0 0 |
| -4.4662 0.2350 0.3786 C 0 0 1 0 0 0 0 0 0 0 0 0 |
| -4.2658 1.6888 0.7287 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -5.3332 -0.1576 -0.7931 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -4.8379 -0.9822 -1.8173 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -5.6376 -1.3627 -2.8978 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -6.9594 -0.9317 -2.9705 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -7.4794 -0.1244 -1.9623 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -0.0310 -0.4422 2.8226 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 3.8058 -1.7232 -0.2374 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| 6.6072 2.8238 -1.1663 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| 5.5546 0.8719 -2.0827 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| 1.1507 -1.3136 0.8945 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 1.0549 -0.3422 5.2883 Cl 0 0 0 0 0 0 0 0 0 0 0 0 |
| -7.0970 0.8809 -0.1036 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 3.1038 -1.4611 3.6803 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 3.3234 -3.2761 0.9892 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 4.3999 -2.1117 1.7309 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 4.6747 0.1230 1.6914 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 7.3312 4.3123 0.1871 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 6.1698 2.7200 2.0711 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 4.5551 -0.8729 -2.5045 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -1.6727 1.2266 1.6117 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -2.8718 1.1502 -0.8974 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -4.5021 -0.4569 1.2177 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -4.2278 1.9492 1.7793 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -4.7313 2.4446 0.1053 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -3.8079 -1.3358 -1.7689 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -5.2248 -1.9973 -3.6778 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -7.5833 -1.2281 -3.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -8.5126 0.2093 -2.0106 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -0.9271 -0.0439 3.2886 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 6.9270 3.1954 -2.0488 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 1.1585 -1.5632 -0.1674 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 2 3 2 0 |
| 2 4 1 0 |
| 5 6 2 0 |
| 6 7 1 0 |
| 7 8 1 0 |
| 9 10 2 0 |
| 10 11 1 0 |
| 11 12 2 0 |
| 11 14 1 0 |
| 13 14 2 0 |
| 9 15 1 0 |
| 2 16 1 0 |
| 17 16 1 0 |
| 17 18 1 0 |
| 17 19 1 0 |
| 18 19 1 0 |
| 18 20 1 0 |
| 1 20 2 0 |
| 20 21 1 0 |
| 21 22 2 0 |
| 22 23 1 0 |
| 23 24 2 0 |
| 1 24 1 0 |
| 4 25 2 0 |
| 5 25 1 0 |
| 8 26 1 0 |
| 9 26 1 0 |
| 12 27 1 0 |
| 13 27 1 0 |
| 12 28 1 0 |
| 15 28 2 0 |
| 4 29 1 0 |
| 7 29 2 0 |
| 5 30 1 0 |
| 1 31 1 0 |
| 6 32 1 0 |
| 8 33 1 0 |
| 8 34 1 0 |
| 10 35 1 0 |
| 13 36 1 0 |
| 14 37 1 0 |
| 15 38 1 0 |
| 16 39 1 0 |
| 17 40 1 6 |
| 18 41 1 1 |
| 19 42 1 0 |
| 19 43 1 0 |
| 21 44 1 0 |
| 22 45 1 0 |
| 23 46 1 0 |
| 24 47 1 0 |
| 25 48 1 0 |
| 27 49 1 0 |
| 29 50 1 0 |
| M END |
| $$$$ |
|
|
