RDKit 3D 51 55 0 0 0 0 0 0 0 0999 V2000 3.6139 0.3344 -0.9672 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1944 -0.5086 -0.0505 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1430 -1.5495 0.4712 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8255 -0.5164 0.5261 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2205 -1.8354 0.1995 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9329 -2.8033 -0.0910 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2236 -2.0274 0.2117 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.6044 -3.2374 -0.3807 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6625 -2.1381 1.5540 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5748 -1.1334 1.7266 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.5008 -1.2643 2.8544 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2072 -1.0284 0.4673 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0308 -0.8716 -0.3064 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.2711 -0.8525 -1.7537 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.1849 -2.0054 -2.1435 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9713 0.4157 -2.1399 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2734 1.6592 -1.7109 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0741 1.6490 -0.2098 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0013 2.6869 0.0933 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.4830 3.7302 1.0653 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1980 1.9184 0.6344 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9811 0.5648 -0.0039 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.4805 0.3789 0.2986 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7921 0.1616 1.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5513 0.7713 2.7408 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0075 1.1015 -1.3912 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6582 0.2550 -1.3307 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8233 -1.9259 1.4536 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2330 -2.3798 -0.2583 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1729 -1.1124 0.5905 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9544 -0.4066 1.6369 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0749 -3.6001 -0.9858 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0291 -0.8235 3.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7047 -2.3347 3.0601 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4238 -0.6889 2.6694 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3306 -0.9823 -2.2922 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7311 -2.3773 -1.2704 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9321 -1.6751 -2.8968 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5989 -2.8174 -2.6555 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9917 0.3769 -1.7093 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0949 0.4335 -3.2443 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3095 1.7769 -2.2551 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9199 2.5204 -1.9488 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0198 1.8886 0.2982 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3488 3.2106 -0.8083 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1155 4.4445 0.4681 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3907 4.2998 1.4089 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0964 3.3409 1.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1486 2.4064 0.3532 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2057 1.8818 1.7429 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0557 0.6887 -1.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 20 19 1 0 19 21 1 0 21 22 1 0 22 4 1 0 4 2 1 0 2 3 1 0 2 1 2 3 4 5 1 0 5 6 2 0 5 7 1 0 7 8 1 6 7 9 1 0 9 10 1 0 10 11 1 1 10 12 1 0 13 12 1 1 13 14 1 0 14 15 1 0 14 16 1 0 16 17 1 0 17 18 1 0 18 23 1 0 23 24 1 1 24 25 2 0 18 19 1 0 23 22 1 0 13 7 1 0 23 13 1 0 24 10 1 0 20 46 1 0 20 47 1 0 20 48 1 0 19 45 1 6 21 49 1 0 21 50 1 0 22 51 1 6 4 31 1 1 3 28 1 0 3 29 1 0 3 30 1 0 1 26 1 0 1 27 1 0 8 32 1 0 11 33 1 0 11 34 1 0 11 35 1 0 14 36 1 6 15 37 1 0 15 38 1 0 15 39 1 0 16 40 1 0 16 41 1 0 17 42 1 0 17 43 1 0 18 44 1 1 M END