RDKit 3D 81 85 0 0 0 0 0 0 0 0999 V2000 -6.8050 3.3200 -2.9845 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9818 2.1010 -2.7881 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3579 1.6033 -3.7531 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8618 1.4647 -1.5610 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0642 0.3025 -1.4204 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.0296 0.6459 -0.3279 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.4760 -0.4938 0.1924 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1333 -0.6399 0.0131 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2790 0.4514 0.6360 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0157 0.1483 0.3653 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9118 0.1004 1.3873 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1778 0.4043 0.8894 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3151 -0.3415 0.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4057 -1.6036 1.4202 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5773 -2.3586 1.4156 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6169 -3.6329 1.9650 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6878 -1.7817 0.8425 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8692 -2.4919 0.8146 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9091 -3.6437 1.3097 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9682 -1.8809 0.2291 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8911 -0.6021 -0.3111 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0459 0.0381 -0.9249 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2814 -0.5384 -1.0307 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3629 0.1020 -1.6229 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1645 1.3753 -2.1213 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2189 2.0608 -2.7252 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9188 1.9879 -2.0286 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8860 1.3227 -1.4395 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7476 0.0187 -0.2551 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6717 -0.5218 0.2925 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4880 0.1728 0.3272 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6193 1.0660 2.5119 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5146 2.3612 1.9859 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6950 0.5934 3.0989 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.4851 -0.7117 3.5420 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7135 0.6858 2.0169 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.7471 -0.2110 2.3924 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7292 1.3726 0.6116 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7835 0.7612 1.2092 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.7748 1.8735 1.5929 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5440 -0.2480 0.4442 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.8376 0.2029 0.0895 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9023 -0.7903 -0.7767 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.8901 -1.3022 -1.6479 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8304 -2.6310 -2.0383 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7898 -3.2861 -2.9359 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8691 -3.3310 -1.5807 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.6887 3.2952 -2.3182 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0810 3.4285 -4.0541 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1786 4.1918 -2.7074 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5888 -0.0012 -2.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3266 1.3317 -0.8392 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8647 -0.6412 -1.0829 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8188 -1.6499 0.3705 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5018 1.3792 0.0257 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9265 -0.9068 1.8419 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5284 -2.0594 1.8732 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7797 -4.0191 2.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8716 -2.4486 0.2184 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4323 -1.5267 -0.6429 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3184 -0.4130 -1.6748 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4079 1.9950 -3.7196 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8080 2.9782 -2.4293 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9214 1.7963 -1.3669 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4375 1.1534 -0.0899 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4590 0.9971 3.2392 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2438 2.5026 1.3275 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9658 1.2683 3.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3163 -0.7480 4.0982 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2139 1.6960 2.1243 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0540 0.0130 3.3251 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4226 0.3813 2.2104 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2663 2.7992 1.8923 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4000 2.0250 0.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4527 1.4549 2.3503 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7443 -1.1202 1.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3051 -0.5254 -0.3872 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1638 -1.6012 -0.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3900 -3.3624 -3.9737 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9157 -4.3307 -2.5844 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7926 -2.8271 -2.9435 H 0 0 0 0 0 0 0 0 0 0 0 0 40 39 1 0 39 38 1 0 38 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 1 0 15 17 2 0 17 18 1 0 18 19 2 0 18 20 1 0 20 21 2 0 21 29 1 0 29 30 1 0 30 31 2 0 21 22 1 0 22 23 2 0 23 24 1 0 24 25 2 0 25 26 1 0 25 27 1 0 27 28 2 0 11 32 1 0 32 33 1 0 32 34 1 0 34 35 1 0 34 36 1 0 36 37 1 0 6 5 1 0 5 4 1 0 4 2 1 0 2 1 1 0 2 3 2 0 5 43 1 0 43 44 1 0 44 45 1 0 45 46 1 0 45 47 2 0 43 41 1 0 41 42 1 0 41 39 1 0 36 9 1 0 31 13 1 0 28 22 1 0 30 17 1 0 40 73 1 0 40 74 1 0 40 75 1 0 39 72 1 1 6 52 1 6 8 53 1 0 8 54 1 0 9 55 1 6 11 56 1 1 14 57 1 0 16 58 1 0 20 59 1 0 31 65 1 0 23 60 1 0 24 61 1 0 26 62 1 0 27 63 1 0 28 64 1 0 32 66 1 1 33 67 1 0 34 68 1 1 35 69 1 0 36 70 1 6 37 71 1 0 5 51 1 6 1 48 1 0 1 49 1 0 1 50 1 0 43 78 1 1 46 79 1 0 46 80 1 0 46 81 1 0 41 76 1 1 42 77 1 0 M END