RDKit 3D 48 49 0 0 0 0 0 0 0 0999 V2000 -4.1642 -0.4540 3.7726 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0354 -0.1710 2.3914 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0248 -0.5977 1.5776 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1185 -1.3070 2.0856 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9289 -0.2836 0.1569 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8607 0.4700 -0.4593 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6532 0.6930 -1.8118 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3896 -0.4399 -2.6067 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.2598 -0.0545 -4.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2036 -1.1598 -2.0852 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.0438 -0.8192 -2.9925 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8680 0.2920 -3.4555 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8295 -0.7343 -0.6987 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7302 0.3359 -0.7937 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1716 0.6420 0.5332 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7811 1.4290 1.2978 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0164 0.0950 0.9900 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4952 0.4337 2.2747 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8088 -0.3206 2.4987 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8055 0.0554 1.4776 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8375 -0.6797 0.3089 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7276 -0.4126 -0.7043 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6205 0.6342 -0.5364 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5048 0.8799 -1.5725 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5862 1.3643 0.6281 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6911 1.0991 1.6519 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4993 -1.2579 4.1112 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1242 0.4607 4.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2195 -0.8391 3.8934 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6828 0.8385 0.1325 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2415 -1.1911 -2.5902 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2734 -0.1135 -4.5153 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6240 -0.7873 -4.5596 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9506 1.0049 -4.1869 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3204 -2.2754 -2.1165 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3050 -1.5692 -3.2735 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2939 -1.5971 -0.1856 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0934 -0.1365 -1.3791 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0730 1.2292 -1.3296 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6834 1.5179 2.4013 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8115 0.0995 3.0917 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1859 -0.1365 3.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5986 -1.3881 2.4147 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1346 -1.5086 0.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7278 -1.0161 -1.6213 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3991 0.4132 -1.5759 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2802 2.1840 0.7666 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6623 1.6715 2.5667 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 3 5 1 0 5 6 2 0 6 7 1 0 7 8 1 0 8 9 1 0 8 10 1 0 10 11 1 0 11 12 2 0 10 13 1 0 13 14 1 0 14 15 1 0 15 16 2 0 15 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 2 0 21 22 1 0 22 23 2 0 23 24 1 0 23 25 1 0 25 26 2 0 13 5 1 0 26 20 1 0 1 27 1 0 1 28 1 0 1 29 1 0 6 30 1 0 8 31 1 6 9 32 1 0 9 33 1 0 9 34 1 0 10 35 1 1 11 36 1 0 13 37 1 1 14 38 1 0 14 39 1 0 18 40 1 0 18 41 1 0 19 42 1 0 19 43 1 0 21 44 1 0 22 45 1 0 24 46 1 0 25 47 1 0 26 48 1 0 M END