RDKit 3D 96100 0 0 0 0 0 0 0 0999 V2000 9.0259 -1.1187 -3.1066 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9522 -1.1749 -4.0072 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6540 -1.2542 -3.5855 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3432 -1.2768 -2.2224 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0301 -1.3587 -1.8177 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6758 -1.3612 -0.3934 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6190 -1.2529 0.4717 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3874 -1.4761 0.0115 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8625 -1.4588 1.2747 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6595 -0.1832 1.9979 C 0 0 2 0 0 0 0 0 0 0 0 0 1.6521 0.5622 1.3407 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9888 1.3864 2.2370 C 0 0 2 0 0 0 0 0 0 0 0 0 0.1614 2.2179 1.5679 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1214 2.3667 1.8899 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0417 1.1623 1.8762 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.9393 0.3899 0.6155 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.3460 -1.0220 0.6565 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4535 -2.0329 0.9213 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8375 -3.3694 0.9729 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9824 -4.3134 1.2233 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0447 -5.0694 1.4864 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1977 -3.6996 0.7436 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5786 -5.0335 0.7973 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0716 -2.6826 0.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4195 -3.0215 0.2578 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3386 -1.9740 -0.0116 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6552 -1.3720 0.4372 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6594 1.1524 -0.4484 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7882 1.8838 -0.1426 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4527 2.6046 -1.1569 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0131 2.6070 -2.4568 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6982 3.3348 -3.4356 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8503 4.0868 -3.1115 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8918 1.8743 -2.7392 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4130 1.8440 -4.0289 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2158 1.1525 -1.7516 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0680 0.4270 -2.1034 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1585 1.1127 -2.1229 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3668 1.9679 1.2279 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4116 1.6047 2.2760 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.0524 0.7290 3.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3075 1.2927 3.5812 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0715 2.1308 3.0106 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3163 1.5277 4.2313 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3378 2.1512 2.2133 C 0 0 2 0 0 0 0 0 0 0 0 0 3.0234 2.7292 0.9615 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8584 0.7209 1.9763 C 0 0 1 0 0 0 0 0 0 0 0 0 4.8212 0.3975 2.9144 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0503 -1.4166 -2.7891 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3618 -1.3939 -4.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6698 -1.3120 -4.5556 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0351 -1.2854 -5.9048 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9898 -0.2138 -2.4852 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9985 -1.0842 -3.6572 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0087 -2.0008 -2.4322 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1201 -1.2337 -1.4817 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5489 -2.1017 1.9395 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8954 -2.0642 1.3448 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3180 -0.4462 3.0316 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5033 0.7442 2.9971 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3057 2.9790 2.8292 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5795 3.0495 1.1031 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6722 0.4890 2.6972 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8586 0.4112 0.2865 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4205 -1.7536 1.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4094 -5.6352 0.5806 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0911 -5.9067 2.2423 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9645 -4.5401 1.9194 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5810 -5.2162 0.6303 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3476 -2.4179 -0.0911 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1223 -1.4594 -0.9706 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3066 -1.1951 0.7954 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4306 -0.6545 0.2038 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3391 3.1729 -0.8991 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6488 4.8967 -2.3672 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6892 3.4825 -2.7694 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1634 4.5727 -4.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5768 1.3147 -4.3012 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7478 0.7803 -3.0336 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7612 0.9649 -1.2197 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0702 2.2075 -2.2327 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2487 1.2627 1.2868 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7686 3.0203 1.3674 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2224 2.5797 2.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2168 -0.2781 2.9664 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4111 0.7586 4.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0362 0.6105 3.5394 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7775 3.1776 3.2176 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9221 2.1475 4.7364 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1207 2.7755 2.6516 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5437 2.3036 0.2279 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2544 0.7710 0.9476 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7336 -0.5253 3.2154 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0190 -1.4793 -2.4422 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5844 -1.4420 -4.8935 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2974 -1.3272 -6.5900 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 49 2 0 49 50 1 0 50 51 2 0 51 52 1 0 5 6 1 0 6 7 2 0 6 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 1 0 14 15 1 0 15 40 1 0 40 41 1 0 41 42 1 0 40 39 1 0 39 29 1 0 29 28 2 0 28 16 1 0 16 17 1 0 17 18 2 0 18 19 1 0 19 20 1 0 20 21 1 0 19 22 2 0 22 23 1 0 22 24 1 0 24 25 1 0 25 26 1 0 24 27 2 0 28 36 1 0 36 37 1 0 37 38 1 0 36 34 2 0 34 35 1 0 34 31 1 0 31 32 1 0 32 33 1 0 31 30 2 0 12 43 1 0 43 44 1 0 43 45 1 0 45 46 1 0 45 47 1 0 47 48 1 0 51 3 1 0 47 10 1 0 16 15 1 0 27 17 1 0 30 29 1 0 1 53 1 0 1 54 1 0 1 55 1 0 4 56 1 0 49 94 1 0 50 95 1 0 52 96 1 0 9 57 1 0 9 58 1 0 10 59 1 1 12 60 1 1 14 61 1 0 14 62 1 0 15 63 1 1 40 84 1 1 41 85 1 0 41 86 1 0 42 87 1 0 39 82 1 0 39 83 1 0 16 64 1 6 18 65 1 0 21 66 1 0 21 67 1 0 21 68 1 0 23 69 1 0 26 70 1 0 26 71 1 0 26 72 1 0 27 73 1 0 38 79 1 0 38 80 1 0 38 81 1 0 35 78 1 0 33 75 1 0 33 76 1 0 33 77 1 0 30 74 1 0 43 88 1 1 44 89 1 0 45 90 1 1 46 91 1 0 47 92 1 6 48 93 1 0 M END