RDKit 3D 80 85 0 0 0 0 0 0 0 0999 V2000 -4.8553 3.2630 2.2578 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5333 2.0890 1.9908 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2367 0.8915 2.5583 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8821 0.2182 1.3452 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.7145 1.2762 0.6772 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3927 2.1715 1.4555 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1651 3.1798 0.8779 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2467 3.2759 -0.5122 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0270 4.2948 -1.0265 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5593 2.3681 -1.2805 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6232 2.4405 -2.6613 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7858 1.3585 -0.6947 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7578 -0.1809 0.4373 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8941 -1.3207 -0.3231 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9812 -2.1485 -0.3131 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8402 -1.6603 -1.1717 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7101 -0.9242 -1.2733 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5797 0.2295 -0.5004 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6078 0.5883 0.3492 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4738 1.7436 1.1268 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3211 0.9871 -0.6725 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1644 0.0311 -0.5102 C 0 0 2 0 0 0 0 0 0 0 0 0 1.0785 0.6215 -0.7738 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1593 0.7767 0.0313 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0658 0.3515 1.1882 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3757 1.4303 -0.5062 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6262 0.6194 -0.2646 C 0 0 2 0 0 0 0 0 0 0 0 0 4.4536 -0.6348 -0.8864 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9783 0.4686 1.1658 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2742 -0.3071 1.3643 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4462 0.3339 0.7356 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7676 0.0172 -0.5592 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8688 0.5862 -1.1836 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6637 1.4804 -0.5197 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7752 2.0599 -1.1368 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3224 1.7902 0.7924 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1275 2.6965 1.4674 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2390 1.2353 1.4164 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2796 -1.0682 -1.5271 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0130 -2.4289 -1.0296 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5600 -2.7500 0.1787 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8063 -4.0808 0.5607 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4996 -5.1033 -0.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7396 -6.4368 0.0881 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0497 -4.8113 -1.4953 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3659 -5.8352 -2.3575 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2882 -3.5167 -1.8646 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6117 -1.1790 -2.0835 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4136 0.1864 2.8813 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9242 1.1144 3.3609 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5118 -0.6188 1.6304 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3891 2.1711 2.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6918 3.8766 1.5232 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1849 4.4980 -1.9899 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1748 3.1631 -3.0894 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2426 0.6411 -1.3191 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8012 -2.0178 0.2474 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9125 -2.5618 -1.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3288 1.8020 0.0447 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2346 1.4164 -1.7105 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2745 -0.3823 0.5082 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4846 2.4667 -0.0622 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2400 1.5424 -1.6131 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4743 1.0812 -0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5631 -1.0170 -0.6482 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2028 -0.1751 1.6709 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9971 1.4245 1.6883 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4165 -0.3816 2.4472 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1203 -1.3567 1.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1584 -0.6919 -1.1102 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1089 0.3261 -2.2003 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9888 1.8088 -2.0886 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9776 2.9906 2.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9685 1.4806 2.4565 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4400 -0.9141 -2.3867 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8107 -1.9730 0.8589 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2425 -4.2674 1.5298 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4986 -7.1818 -0.5673 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7728 -5.6792 -3.2634 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7289 -3.2593 -2.8351 H 0 0 0 0 0 0 0 0 0 0 0 0 28 27 1 0 27 29 1 0 29 30 1 0 30 31 1 0 31 32 2 0 32 33 1 0 33 34 2 0 34 35 1 0 34 36 1 0 36 37 1 0 36 38 2 0 27 26 1 0 26 24 1 0 24 25 2 0 24 23 1 0 23 22 1 0 22 21 1 0 21 18 1 0 18 19 2 0 19 20 1 0 20 2 1 0 2 1 2 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 2 0 6 7 1 0 7 8 2 0 8 9 1 0 8 10 1 0 10 11 1 0 10 12 2 0 4 13 1 0 13 14 2 0 14 15 1 0 14 16 1 0 16 17 2 0 17 48 1 0 48 39 1 0 39 40 1 0 40 41 2 0 41 42 1 0 42 43 2 0 43 44 1 0 43 45 1 0 45 46 1 0 45 47 2 0 38 31 1 0 39 22 1 0 47 40 1 0 17 18 1 0 13 19 1 0 12 5 1 0 28 65 1 0 27 64 1 6 29 66 1 0 29 67 1 0 30 68 1 0 30 69 1 0 32 70 1 0 33 71 1 0 35 72 1 0 37 73 1 0 38 74 1 0 26 62 1 0 26 63 1 0 22 61 1 1 21 59 1 0 21 60 1 0 3 49 1 0 3 50 1 0 4 51 1 1 6 52 1 0 7 53 1 0 9 54 1 0 11 55 1 0 12 56 1 0 15 57 1 0 16 58 1 0 39 75 1 6 41 76 1 0 42 77 1 0 44 78 1 0 46 79 1 0 47 80 1 0 M END