RDKit 3D 81 85 0 0 0 0 0 0 0 0999 V2000 7.7438 1.4540 1.2053 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6132 2.0533 0.4651 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7435 3.4712 0.0202 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5188 1.3692 0.2053 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2866 -0.0461 0.6107 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0775 -0.1557 1.4659 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2086 -0.3114 2.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4130 -0.3853 3.4917 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0401 -0.4052 3.5682 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8106 -0.3398 2.9581 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6387 -0.4307 3.6945 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7202 -0.1794 1.5763 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5234 -0.1101 0.9155 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5334 -0.1887 1.5465 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4695 0.0505 -0.4845 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7778 0.0919 -1.0824 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5169 -1.0793 -1.3748 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.2462 -1.5105 -2.6747 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6553 -2.8327 -2.8538 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0360 -3.0455 -2.2149 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.9350 -3.5611 -0.9409 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6908 -1.6748 -2.2455 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.3491 -1.0893 -3.4635 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9812 -0.8425 -1.1618 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.3563 -1.2447 0.0900 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0962 -0.3338 0.7964 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.5286 -0.0416 2.0086 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2028 0.9568 2.7029 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.9540 2.3333 2.1341 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6891 0.7201 2.7472 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.2260 1.0596 3.9832 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9250 -0.7464 2.4562 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.2540 -1.1115 2.5776 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4614 -1.0018 1.0387 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.3367 -0.4878 0.1099 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6289 0.1414 -1.1787 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7007 0.3188 -2.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9374 0.0721 -3.2203 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1344 0.2746 -4.5528 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0963 0.7308 -5.3281 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3225 0.9308 -6.6938 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8743 0.9835 -4.7826 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6864 0.7719 -3.4147 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7854 0.0666 -0.4919 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8518 -0.0835 0.7977 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6120 1.5323 2.3206 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9450 0.3997 0.9628 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6787 2.0486 1.0102 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3930 3.6108 -0.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7384 3.9603 -0.0865 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2327 4.0042 0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7256 1.8746 -0.3455 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0888 -0.5895 -0.3642 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1669 -0.5321 1.0259 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2893 -0.3253 3.0133 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1257 -0.5291 4.6341 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7146 -0.5469 4.6959 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0721 -1.8731 -0.7292 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7831 -2.9954 -3.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9237 -3.5685 -2.4898 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6225 -3.7835 -2.8257 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1472 -4.1145 -0.7791 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7641 -1.7138 -2.0812 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2675 -0.1086 -3.4218 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3016 0.1975 -1.3912 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2758 0.6148 0.2514 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8268 0.9543 3.7436 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8848 2.5191 1.9131 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6144 2.4369 1.2489 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3406 3.0579 2.8862 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1577 1.2926 1.9148 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1643 1.3263 3.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2534 -1.3068 3.1548 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3594 -2.0186 2.9731 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3669 -2.1084 0.9473 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5327 -1.1919 -0.5535 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7782 -0.2964 -2.6059 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1090 0.0726 -4.9808 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2230 0.7474 -7.1096 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0508 1.3426 -5.3819 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2870 0.9990 -3.0057 H 0 0 0 0 0 0 0 0 0 0 0 0 29 28 1 0 28 27 1 0 27 26 1 0 26 25 1 0 25 24 1 0 24 22 1 0 22 23 1 0 22 20 1 0 20 21 1 0 20 19 1 0 19 18 1 0 18 17 1 0 17 16 1 0 16 15 1 0 15 36 2 0 36 44 1 0 44 45 1 0 45 6 2 0 6 5 1 0 5 4 1 0 4 2 2 3 2 1 1 0 2 3 1 0 6 7 1 0 7 8 1 0 7 9 2 0 9 10 1 0 10 11 1 0 10 12 2 0 12 13 1 0 13 14 2 0 36 37 1 0 37 38 2 0 38 39 1 0 39 40 2 0 40 41 1 0 40 42 1 0 42 43 2 0 26 34 1 0 34 35 1 0 34 32 1 0 32 33 1 0 32 30 1 0 30 31 1 0 30 28 1 0 17 24 1 0 13 15 1 0 43 37 1 0 12 45 1 0 29 68 1 0 29 69 1 0 29 70 1 0 28 67 1 1 26 66 1 6 24 65 1 6 22 63 1 1 23 64 1 0 20 61 1 6 21 62 1 0 19 59 1 0 19 60 1 0 17 58 1 1 5 53 1 0 5 54 1 0 4 52 1 0 1 46 1 0 1 47 1 0 1 48 1 0 3 49 1 0 3 50 1 0 3 51 1 0 8 55 1 0 9 56 1 0 11 57 1 0 38 77 1 0 39 78 1 0 41 79 1 0 42 80 1 0 43 81 1 0 34 75 1 6 35 76 1 0 32 73 1 1 33 74 1 0 30 71 1 6 31 72 1 0 M END