| 6TW5_9M2_CCC_501 |
| RDKit 3D |
|
|
| 59 62 0 0 0 0 0 0 0 0999 V2000 |
| -0.5711 -4.5320 -2.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 2.0373 -1.2835 -0.1717 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 3.2710 -0.6577 -0.0157 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 0.5790 -2.4655 -1.8189 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 0.6029 -3.8445 -2.1067 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 1.8460 -1.7791 -1.4883 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 2.8526 -1.6358 -2.5104 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 4.9791 0.4031 0.7776 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| 4.1023 -1.0002 -2.3198 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 4.2920 -0.5017 -1.0223 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -2.9051 -4.5009 -2.7108 F 0 0 0 0 0 0 0 0 0 0 0 0 |
| -1.7742 -3.8430 -2.4224 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -1.8325 -2.4806 -2.1455 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -0.6619 -1.7817 -1.8402 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 5.3405 0.1510 -0.4954 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| 3.7414 -0.0681 1.1293 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 3.2057 0.1060 2.5033 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 3.5364 1.4327 3.0501 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| 3.3162 1.4419 4.4997 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 2.7141 2.4789 2.4275 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -0.6074 -0.4380 -1.5733 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| -1.8127 0.2944 -1.3508 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -2.3102 0.1040 0.0825 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -3.4888 0.9622 0.3956 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -3.4734 2.2871 0.9130 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -2.2964 3.1213 1.2622 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -4.7080 2.7713 1.0732 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| -5.5121 1.7727 0.6759 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| -6.9433 1.9619 0.7224 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -4.8331 0.6613 0.2457 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -5.5179 -0.5582 -0.2527 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -0.5532 -5.5945 -2.6265 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 1.2903 -1.3824 0.6036 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 1.5456 -4.3885 -2.0873 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 2.6394 -2.0310 -3.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 5.6121 0.9299 1.3711 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 4.8426 -0.8978 -3.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -2.8053 -2.0083 -2.1875 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 3.6692 -0.6745 3.1217 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 2.1236 -0.0716 2.5329 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 3.9611 0.7041 4.9906 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 2.2755 1.2197 4.7618 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 3.5790 2.4174 4.9235 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 1.6426 2.3198 2.5975 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 2.8870 2.5341 1.3475 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 2.9835 3.4620 2.8313 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -1.5535 1.3499 -1.4999 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -2.5774 0.0793 -2.1053 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -2.5572 -0.9487 0.2629 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -1.4915 0.3234 0.7801 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -1.7269 2.6556 2.0728 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -2.5944 4.1226 1.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -1.6369 3.2334 0.3962 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -7.1741 2.8681 1.2885 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -7.3957 1.0983 1.2153 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -7.3078 2.0580 -0.3027 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -4.8038 -1.2747 -0.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -6.0566 -1.0545 0.5608 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -6.2331 -0.3079 -1.0428 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 2 3 1 0 |
| 1 5 2 0 |
| 4 5 1 0 |
| 4 6 1 0 |
| 2 6 2 0 |
| 6 7 1 0 |
| 7 9 2 0 |
| 3 10 1 0 |
| 9 10 1 0 |
| 11 12 1 0 |
| 1 12 1 0 |
| 12 13 2 0 |
| 13 14 1 0 |
| 4 14 2 0 |
| 10 15 2 0 |
| 8 15 1 0 |
| 3 16 2 0 |
| 8 16 1 0 |
| 16 17 1 0 |
| 17 18 1 0 |
| 18 19 1 0 |
| 18 20 1 0 |
| 14 21 1 0 |
| 21 22 1 0 |
| 22 23 1 0 |
| 23 24 1 0 |
| 24 25 1 0 |
| 25 26 1 0 |
| 25 27 2 0 |
| 27 28 1 0 |
| 28 29 1 0 |
| 24 30 2 0 |
| 28 30 1 0 |
| 30 31 1 0 |
| 1 32 1 0 |
| 2 33 1 0 |
| 5 34 1 0 |
| 7 35 1 0 |
| 8 36 1 0 |
| 9 37 1 0 |
| 13 38 1 0 |
| 17 39 1 0 |
| 17 40 1 0 |
| 19 41 1 0 |
| 19 42 1 0 |
| 19 43 1 0 |
| 20 44 1 0 |
| 20 45 1 0 |
| 20 46 1 0 |
| 22 47 1 0 |
| 22 48 1 0 |
| 23 49 1 0 |
| 23 50 1 0 |
| 26 51 1 0 |
| 26 52 1 0 |
| 26 53 1 0 |
| 29 54 1 0 |
| 29 55 1 0 |
| 29 56 1 0 |
| 31 57 1 0 |
| 31 58 1 0 |
| 31 59 1 0 |
| M END |
| $$$$ |
|
|
