RDKit 3D 76 77 0 0 0 0 0 0 0 0999 V2000 1.3141 4.0837 1.6031 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0033 2.9940 0.5961 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9480 2.1563 0.2094 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6966 1.0900 -0.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4476 -0.2096 -0.4198 C 0 0 1 0 0 0 0 0 0 0 0 0 2.7984 -0.2796 0.9919 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7435 -0.2486 2.0753 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0260 -0.3643 1.4347 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2382 -0.3956 0.5606 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4635 0.5767 -0.3863 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9282 0.0534 -1.0951 S 0 0 0 0 0 0 0 0 0 0 0 0 7.1723 -1.3530 -0.1616 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3001 -2.3592 -0.2284 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1768 -1.8958 -1.1992 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1262 -1.3490 0.6385 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6362 -1.2414 -0.9102 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1405 -2.3640 -0.3921 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6468 -3.5373 -0.4699 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1500 -2.3211 0.3767 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2095 -3.1603 -0.3514 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.9157 -3.2164 -1.6959 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5853 -2.5303 -0.0918 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.8351 -2.6181 1.3764 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5839 -3.4017 -0.8285 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6191 -1.1730 -0.6488 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8331 -0.8888 -1.5365 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5555 -0.0900 -0.2089 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.9819 -0.6255 -0.3911 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3723 1.1480 -0.9991 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.3023 1.1548 -2.0551 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4301 2.4451 -0.3108 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.8275 2.9797 -0.0403 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6581 2.5862 0.9556 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2645 2.0249 0.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3723 2.8634 0.0406 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1588 4.6728 1.1886 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4231 4.6992 1.7108 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6767 3.6218 2.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9362 2.2779 0.6332 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9938 1.4566 -1.7722 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5997 0.8680 -0.8585 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3388 -0.2107 -1.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8449 0.1868 1.6197 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5248 -1.2405 2.4634 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0782 0.4755 2.8678 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1973 -0.4169 2.5279 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8501 1.4725 -0.6113 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8090 -2.3959 0.7521 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8821 -3.3535 -0.5216 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3779 -0.9483 -1.1053 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5651 -1.3139 0.4192 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0342 -2.7999 1.3369 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2513 -4.1970 0.0413 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6988 -3.1152 -2.2918 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1320 -3.3485 1.8754 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5877 -1.6416 1.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8555 -2.9777 1.6476 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7412 -3.0766 -1.8562 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1874 -4.4578 -0.8973 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5140 -3.4897 -0.2306 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4188 0.0173 0.8827 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7386 0.1816 -0.3771 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2512 -1.3017 0.4587 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0816 -1.1361 -1.3743 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3738 1.0683 -1.5262 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1742 1.5053 -1.8166 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9862 3.2080 -1.0223 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4359 2.3437 0.5979 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6558 3.9259 0.5576 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3299 3.3438 -0.9616 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2170 2.2383 1.8543 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5333 3.6980 1.1307 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2190 0.9599 0.7009 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8636 2.1478 1.9601 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4057 2.6148 -1.0289 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8181 3.9045 0.0901 H 0 0 0 0 0 0 0 0 0 0 0 0 32 31 1 0 31 33 1 0 33 34 1 0 34 35 1 0 35 2 1 0 2 1 1 0 2 3 2 0 3 4 1 0 4 5 1 0 5 16 1 0 16 17 1 0 17 18 2 0 17 19 1 0 19 20 1 0 20 21 1 0 20 22 1 0 22 23 1 1 22 24 1 0 22 25 1 0 25 26 2 0 25 27 1 0 27 28 1 0 27 29 1 0 29 30 1 0 5 6 1 0 6 7 1 0 6 8 2 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 12 15 2 0 29 31 1 0 15 9 1 0 32 68 1 0 32 69 1 0 32 70 1 0 31 67 1 6 33 71 1 0 33 72 1 0 34 73 1 0 34 74 1 0 35 75 1 0 35 76 1 0 1 36 1 0 1 37 1 0 1 38 1 0 3 39 1 0 4 40 1 0 4 41 1 0 5 42 1 6 19 51 1 0 19 52 1 0 20 53 1 1 21 54 1 0 23 55 1 0 23 56 1 0 23 57 1 0 24 58 1 0 24 59 1 0 24 60 1 0 27 61 1 1 28 62 1 0 28 63 1 0 28 64 1 0 29 65 1 6 30 66 1 0 7 43 1 0 7 44 1 0 7 45 1 0 8 46 1 0 10 47 1 0 13 48 1 0 13 49 1 0 14 50 1 0 M END