RDKit 3D 49 51 0 0 0 0 0 0 0 0999 V2000 0.3509 -0.3414 2.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2055 0.1438 0.7220 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4129 -0.2026 0.0588 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4503 0.7633 0.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3084 1.9364 0.8353 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7005 0.5451 -0.4256 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7188 1.4678 -0.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9837 1.2531 -0.8154 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2268 0.1084 -1.5187 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2320 -0.8157 -1.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9551 -0.5985 -1.1269 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9924 -1.5038 -1.2403 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7854 -1.2894 -0.6644 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9563 -2.2056 -0.8416 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1608 -0.2861 0.3939 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.2742 -1.7869 0.6672 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0396 0.3871 1.4705 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7914 1.5639 0.8674 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7805 0.9724 -0.0849 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.7459 0.2970 0.6820 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0137 0.0255 -0.9844 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.2973 0.5238 -2.4051 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7080 -1.2958 -0.9093 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6679 0.0619 -0.8105 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2824 -0.9252 2.3196 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5168 0.5746 2.8658 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5479 -0.8215 2.5703 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1435 1.2585 0.8354 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5737 2.3382 1.3262 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5633 2.3608 0.2801 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7934 1.9659 -0.6998 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2015 -0.1238 -1.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3897 -1.7363 -2.2424 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1952 -2.3665 -1.7818 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3781 -2.1796 1.2259 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6017 -2.3886 -0.1702 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0813 -1.9803 1.4585 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6980 -0.3237 1.9563 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4076 0.8663 2.2704 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0715 2.1604 0.2812 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2531 2.1502 1.6917 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3102 1.7715 -0.6105 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7798 0.6217 1.6103 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4176 0.6033 -2.4809 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0118 -0.2725 -3.1001 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8796 1.5156 -2.5939 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8763 -1.7016 0.0925 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3648 -2.0229 -1.6712 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7800 -1.0681 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 4 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 12 13 1 0 13 14 2 0 2 15 1 0 15 16 1 1 15 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 19 21 1 0 21 22 1 6 21 23 1 0 21 24 1 0 13 3 1 0 24 15 1 0 11 6 1 0 1 25 1 0 1 26 1 0 1 27 1 0 2 28 1 1 5 29 1 0 7 30 1 0 8 31 1 0 9 32 1 0 10 33 1 0 12 34 1 0 16 35 1 0 16 36 1 0 16 37 1 0 17 38 1 0 17 39 1 0 18 40 1 0 18 41 1 0 19 42 1 6 20 43 1 0 22 44 1 0 22 45 1 0 22 46 1 0 23 47 1 0 23 48 1 0 23 49 1 0 M END