RDKit 3D 48 48 0 0 0 0 0 0 0 0999 V2000 -6.9726 1.0473 -0.4535 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5822 -0.1296 0.3951 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0798 -0.1727 0.5996 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.6164 -1.3400 1.4501 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5193 1.0952 0.8257 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2277 0.4212 -0.4132 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.7549 0.1426 -0.5438 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9642 0.5240 0.6847 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5108 0.1817 0.3719 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1278 -1.2177 0.1194 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4046 1.1312 0.3668 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8180 1.0692 0.1039 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4806 -0.1617 -0.3596 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9794 0.0859 -0.5296 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4572 1.1143 -1.4758 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8134 -0.6296 0.1775 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2533 -0.4615 0.0798 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7224 0.3926 -0.7030 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1422 -1.2082 0.8185 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5504 -1.0512 0.7299 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0248 1.3510 -0.3066 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3135 1.8867 -0.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7619 0.7999 -1.5262 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0455 0.0057 1.3976 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9783 -1.0779 -0.0133 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7950 -1.9113 0.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4451 -2.0813 1.5977 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3375 -0.9595 2.4664 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7293 0.9232 -1.2832 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6463 -0.9247 -0.7782 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3774 0.7042 -1.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3088 -0.1137 1.5226 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0445 1.5848 0.8925 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3797 -1.6785 1.0232 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1086 -1.8057 0.1181 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3240 -1.4504 -0.8311 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0355 2.1537 0.6151 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1729 1.9522 -0.5469 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3493 1.3462 1.0881 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1742 -0.2984 -1.4493 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4150 -1.0538 0.2351 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0673 0.6729 -2.2909 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5896 1.5957 -2.0036 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9915 1.9107 -0.9095 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4511 -1.4018 0.8878 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7323 0.0437 0.6276 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9720 -1.5787 -0.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0673 -1.4279 1.6131 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 3 2 1 6 3 4 1 0 3 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 9 11 2 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 14 16 2 0 16 17 1 0 17 18 2 0 17 19 1 0 19 20 1 0 6 3 1 0 1 21 1 0 1 22 1 0 1 23 1 0 2 24 1 0 2 25 1 0 4 26 1 0 4 27 1 0 4 28 1 0 6 29 1 6 7 30 1 0 7 31 1 0 8 32 1 0 8 33 1 0 10 34 1 0 10 35 1 0 10 36 1 0 11 37 1 0 12 38 1 0 12 39 1 0 13 40 1 0 13 41 1 0 15 42 1 0 15 43 1 0 15 44 1 0 16 45 1 0 20 46 1 0 20 47 1 0 20 48 1 0 M END