RDKit 3D 42 44 0 0 0 0 0 0 0 0999 V2000 -2.4250 2.5811 3.1067 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2609 2.0400 2.1325 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8842 1.2243 1.0881 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5731 0.8727 0.9183 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1237 0.0432 -0.1265 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2909 -0.2726 -0.1609 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0362 0.0378 0.9042 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3022 -0.1877 1.0047 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9476 0.1935 2.1828 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2790 -0.0186 2.3461 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9204 0.3624 3.5224 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0064 -0.6063 1.3644 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4004 -1.0075 0.1599 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1459 -1.5936 -0.8093 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0491 -0.7869 0.0058 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3553 -1.1349 -1.1227 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9154 -1.6857 -2.1018 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9790 -0.8589 -1.1652 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3599 -1.2317 -2.3431 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3301 -0.3288 -3.4711 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0415 -0.4373 -1.0161 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3775 -0.0953 -0.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2797 -0.5932 -1.7792 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8568 -1.4134 -2.8244 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7794 0.7205 0.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1190 1.0782 0.3386 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6177 1.8740 3.4063 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9939 2.8549 4.0358 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9439 3.4956 2.7206 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8326 1.2639 1.6381 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3818 0.6631 2.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3013 1.3231 3.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0626 -0.7891 1.4604 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9184 -1.9273 -1.6737 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6469 -0.4651 -3.9532 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4016 0.7195 -3.1016 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1105 -0.5680 -4.1941 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7605 -1.1132 -1.8387 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1194 -0.9181 -3.5031 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3403 -2.3235 -2.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7204 -1.7146 -3.4717 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7976 0.7232 -0.3233 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 5 21 2 0 21 22 1 0 22 23 1 0 23 24 1 0 22 25 2 0 25 26 1 0 5 6 1 0 6 18 2 0 18 19 1 0 19 20 1 0 18 16 1 0 16 17 2 0 16 15 1 0 15 13 2 0 13 14 1 0 13 12 1 0 12 10 2 0 10 11 1 0 10 9 1 0 9 8 2 0 8 7 1 0 25 3 1 0 7 6 1 0 8 15 1 0 1 27 1 0 1 28 1 0 1 29 1 0 4 30 1 0 21 38 1 0 24 39 1 0 24 40 1 0 24 41 1 0 26 42 1 0 20 35 1 0 20 36 1 0 20 37 1 0 14 34 1 0 12 33 1 0 11 32 1 0 9 31 1 0 M END