RDKit 3D 90 94 0 0 0 0 0 0 0 0999 V2000 -9.0962 0.3231 -0.1319 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8521 -0.4047 0.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8071 -1.4899 0.8468 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6455 0.1489 -0.1784 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4080 -0.5128 0.1330 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.7838 -0.9017 -1.1503 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3105 -1.0988 -1.1418 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6630 0.1065 -0.5270 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.9633 1.3186 -1.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1658 -0.0113 -0.4633 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4051 -0.1085 -1.5172 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0744 -0.2159 -1.4995 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6902 0.1069 -0.1530 C 0 0 2 0 0 0 0 0 0 0 0 0 1.5152 1.5680 0.0996 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0018 -0.4833 0.0876 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2452 0.2766 -0.0403 C 0 0 2 0 0 0 0 0 0 0 0 0 4.4190 1.3962 0.9686 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6189 0.8097 -1.3901 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5129 -0.1764 -2.5227 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8100 -0.9219 -2.7485 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8853 -0.1446 -2.7113 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2586 -0.6534 -2.9057 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6371 1.2966 -2.4566 C 0 0 1 0 0 0 0 0 0 0 0 0 6.0188 1.9243 -3.5397 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9127 1.3802 -1.2965 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9945 -1.1005 1.4911 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6366 -0.6388 2.0689 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2404 -1.6078 3.0549 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0976 -1.2484 4.3792 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6853 -2.2142 5.4352 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3194 -0.0647 4.7261 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8118 -0.6784 0.8482 C 0 0 2 0 0 0 0 0 0 0 0 0 0.6323 -2.1166 0.4037 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4794 -0.0102 0.8504 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0266 0.5644 1.9023 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3757 1.2060 1.7025 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1595 0.2088 0.8794 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.6331 0.4148 1.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9977 0.0661 2.4537 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0576 1.8499 0.7974 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9430 0.0981 0.5191 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3627 0.0375 -1.1847 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9215 1.4310 -0.0885 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6613 -1.4562 0.7005 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2448 -1.8838 -1.4707 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0913 -0.1937 -1.9751 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9755 -1.1698 -2.2104 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0227 -2.0340 -0.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0200 1.4917 -1.5574 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4197 2.2040 -0.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4969 1.1177 -2.3747 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8762 -0.1130 -2.4833 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3394 -1.2642 -1.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4386 0.4657 -2.2994 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3995 1.7678 0.1305 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8658 2.1543 -0.7473 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8515 1.9077 1.0982 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0991 -1.3842 -0.5936 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0761 -0.4554 0.2187 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1257 2.3890 0.5496 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9738 1.2173 1.9423 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5272 1.5276 1.1722 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9847 1.6712 -1.7021 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7291 -0.9166 -2.3892 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3011 0.3444 -3.4946 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8716 -1.9727 -2.9229 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8181 -0.6425 -1.9384 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8416 0.0001 -3.5887 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2697 -1.6615 -3.3696 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5904 1.8283 -2.2938 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1722 2.9017 -3.5142 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8323 -0.7984 2.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9655 -2.1994 1.4777 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7378 0.3269 2.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6155 -2.6792 5.8281 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0123 -2.9796 5.0329 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1560 -1.6927 6.2406 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3232 -2.6925 1.3201 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1849 -2.2501 -0.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5675 -2.5334 0.0398 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5177 0.5602 2.8252 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2554 2.1641 1.1871 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8901 1.3056 2.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9467 -0.7970 1.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8690 0.9553 3.1161 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3247 -0.7100 2.8522 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0330 -0.2619 2.5509 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1939 2.5269 0.6068 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8207 1.9038 -0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5772 2.2808 1.6837 H 0 0 0 0 0 0 0 0 0 0 0 0 17 16 1 0 16 15 1 0 15 26 1 0 26 27 1 0 27 28 1 0 28 29 1 0 29 30 1 0 29 31 2 0 27 32 1 0 32 33 1 6 32 34 1 0 34 35 2 0 35 36 1 0 36 37 1 0 37 38 1 0 38 39 1 0 38 40 1 0 38 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 6 8 10 1 0 10 11 2 0 11 12 1 0 12 13 1 0 13 14 1 1 5 4 1 0 4 2 1 0 2 1 1 0 2 3 2 0 16 18 1 0 18 19 1 0 19 20 1 0 20 21 2 0 21 22 1 0 21 23 1 0 23 24 1 0 23 25 1 0 13 15 1 0 25 18 1 0 13 32 1 0 10 34 1 0 8 37 1 0 17 60 1 0 17 61 1 0 17 62 1 0 16 59 1 1 15 58 1 6 26 72 1 0 26 73 1 0 27 74 1 1 30 75 1 0 30 76 1 0 30 77 1 0 33 78 1 0 33 79 1 0 33 80 1 0 35 81 1 0 36 82 1 0 36 83 1 0 37 84 1 1 39 85 1 0 39 86 1 0 39 87 1 0 40 88 1 0 40 89 1 0 40 90 1 0 5 44 1 1 6 45 1 0 6 46 1 0 7 47 1 0 7 48 1 0 9 49 1 0 9 50 1 0 9 51 1 0 11 52 1 0 12 53 1 0 12 54 1 0 14 55 1 0 14 56 1 0 14 57 1 0 1 41 1 0 1 42 1 0 1 43 1 0 18 63 1 6 19 64 1 0 19 65 1 0 20 66 1 0 22 67 1 0 22 68 1 0 22 69 1 0 23 70 1 1 24 71 1 0 M END