RDKit 3D 54 57 0 0 0 0 0 0 0 0999 V2000 -2.2008 -2.2771 2.1439 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8003 -1.4484 0.9252 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.9517 -1.3840 -0.1104 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5347 -0.0098 -0.2839 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7781 0.4068 -0.0029 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9462 -0.1977 0.5559 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0567 0.5491 0.6787 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1003 1.9424 0.2585 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0496 2.5840 -0.2834 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8061 1.8160 -0.4453 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6946 2.1999 -0.9388 N 0 0 0 0 0 4 0 0 0 0 0 0 -2.7150 1.1021 -0.8959 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5835 -1.9893 0.3297 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1812 -1.2710 -0.5673 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1122 -0.1295 -0.9061 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3648 -2.0487 -1.0956 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3064 -1.2352 -1.9873 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2599 -0.3828 -1.2728 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8894 0.9570 -0.9250 C 0 0 1 0 0 0 0 0 0 0 0 0 4.0631 1.7779 -0.8015 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9644 1.2459 0.1501 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8527 2.0960 0.8115 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8052 1.5731 1.6905 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8994 0.1944 1.8875 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0497 -0.6670 1.1947 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0958 -0.1362 0.3221 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2300 -1.0153 -0.4934 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3928 -2.2315 -0.4675 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1725 1.5515 -1.9708 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4167 -3.3147 1.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3912 -2.2964 2.8817 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0896 -1.8575 2.6265 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5506 -0.4397 1.2772 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6055 -1.7212 -1.0964 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7446 -2.0888 0.1688 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9324 -1.2356 0.8723 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9657 0.1233 1.0997 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0464 2.4627 0.4011 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1110 3.6212 -0.5899 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5385 3.1392 -1.2966 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3977 0.8873 -1.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8912 1.4303 -0.2597 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3348 -2.9573 0.5115 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9519 -2.8708 -1.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8952 -2.4920 -0.2468 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9124 -1.9514 -2.5579 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7559 -0.6492 -2.7301 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2849 0.9609 -0.0098 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5388 1.7277 -1.7042 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8015 3.1704 0.6532 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4843 2.2426 2.2141 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6496 -0.2089 2.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1456 -1.7432 1.3187 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3981 2.4884 -1.8512 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 2 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 2 13 1 0 13 14 1 0 14 15 2 0 14 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 2 0 22 23 1 0 23 24 2 0 24 25 1 0 25 26 2 0 26 27 1 0 27 28 2 0 19 29 1 0 12 4 1 0 10 5 1 0 27 18 1 0 26 21 1 0 1 30 1 0 1 31 1 0 1 32 1 0 2 33 1 1 3 34 1 0 3 35 1 0 6 36 1 0 7 37 1 0 8 38 1 0 9 39 1 0 11 40 1 0 12 41 1 0 12 42 1 0 13 43 1 0 16 44 1 0 16 45 1 0 17 46 1 0 17 47 1 0 19 48 1 1 20 49 1 0 22 50 1 0 23 51 1 0 24 52 1 0 25 53 1 0 29 54 1 0 M CHG 1 11 1 M END