RDKit 3D 83 85 0 0 0 0 0 0 0 0999 V2000 7.0333 -0.3366 2.6701 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1380 0.2250 1.7741 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9078 -0.7030 0.7669 C 0 0 1 0 0 0 0 0 0 0 0 0 4.4552 -1.1094 0.6836 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5351 0.0429 0.4035 C 0 0 2 0 0 0 0 0 0 0 0 0 2.5788 -0.2897 -0.5288 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2728 -0.1610 -0.0576 C 0 0 2 0 0 0 0 0 0 0 0 0 0.5492 -1.4882 -0.0127 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.0732 -1.7462 1.3176 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3673 -1.6604 -1.1698 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2503 -1.7944 -2.2927 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7353 -1.6805 -1.0989 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5726 -2.5634 -0.4254 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.1411 -3.6352 -1.3692 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7234 -1.8371 0.2622 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.3660 -2.7877 1.2461 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7146 -1.2812 -0.7336 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.1478 -1.0491 -1.9784 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3518 0.0128 -0.2747 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.7252 0.0046 1.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5712 1.1787 -0.7057 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6109 1.5057 -1.8805 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7111 2.0243 0.1793 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.3538 3.1552 0.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9579 2.0081 1.5474 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3328 1.9617 -0.3525 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2328 2.0018 0.6552 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.3061 3.1811 1.5947 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1046 2.0525 0.0067 C 0 0 2 0 0 0 0 0 0 0 0 0 0.1853 3.2738 -0.6983 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4844 0.8853 -0.8183 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4128 1.3964 -1.9322 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3073 1.1463 -0.0065 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0940 0.7032 -1.0631 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5084 1.8232 -1.9874 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3018 -0.0557 -0.5516 C 0 0 2 0 0 0 0 0 0 0 0 0 6.7391 -1.0216 -1.4542 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2915 0.3075 3.5123 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5451 -1.2593 3.0945 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9448 -0.7263 2.1383 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4866 -1.6435 0.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3851 -1.8562 -0.1418 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1539 -1.6377 1.6067 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0500 0.3515 1.3586 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3488 0.1924 0.9943 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3538 -2.2728 -0.1358 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6148 -1.2675 2.0786 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0245 -2.8344 1.5864 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0440 -1.2861 1.4885 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0617 -3.1434 0.3702 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4594 -4.5098 -1.4194 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1541 -3.2106 -2.4091 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1317 -3.9689 -1.0546 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3175 -0.9758 0.8167 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0321 -3.8379 1.0632 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4816 -2.7222 1.2109 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9999 -2.5416 2.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5417 -2.0326 -0.8729 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7803 -1.3330 -2.6975 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3301 0.0739 -0.8406 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9685 -0.3862 1.8535 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6526 -0.6343 1.2725 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0748 1.0242 1.4342 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8797 4.1164 1.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4598 3.2324 0.7507 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1473 2.7657 -1.1204 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2212 1.0062 -0.9036 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3052 1.0898 1.2828 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3048 3.2444 2.0929 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0359 3.0320 2.4102 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4278 4.1026 1.0269 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8697 2.1571 0.8287 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1833 3.0929 -1.5985 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3353 0.3760 -1.3437 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0469 2.2174 -1.5698 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8269 1.7830 -2.7921 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0162 0.5470 -2.3359 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4653 -0.0263 -1.6431 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6136 1.3901 -3.0083 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6666 2.5679 -2.0051 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4454 2.2873 -1.6317 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1522 0.6602 -0.3542 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2143 -0.8933 -2.2989 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 31 1 0 31 32 1 0 31 29 1 0 29 30 1 0 29 27 1 0 27 28 1 0 27 26 1 0 26 23 1 0 23 24 1 0 24 25 1 0 23 21 1 0 21 22 2 0 21 19 1 0 19 20 1 0 19 17 1 0 17 18 1 0 17 15 1 0 15 16 1 0 15 13 1 0 13 14 1 0 13 12 1 0 12 10 1 0 10 11 2 0 10 8 1 0 8 9 1 0 5 33 1 0 33 34 1 0 34 35 1 0 34 36 1 0 36 37 1 0 36 3 1 0 8 7 1 0 23 25 1 1 1 38 1 0 1 39 1 0 1 40 1 0 3 41 1 1 4 42 1 0 4 43 1 0 5 44 1 1 7 45 1 1 31 74 1 6 32 75 1 0 32 76 1 0 32 77 1 0 29 72 1 1 30 73 1 0 27 68 1 1 28 69 1 0 28 70 1 0 28 71 1 0 26 66 1 0 26 67 1 0 24 64 1 0 24 65 1 0 19 60 1 6 20 61 1 0 20 62 1 0 20 63 1 0 17 58 1 6 18 59 1 0 15 54 1 1 16 55 1 0 16 56 1 0 16 57 1 0 13 50 1 1 14 51 1 0 14 52 1 0 14 53 1 0 8 46 1 6 9 47 1 0 9 48 1 0 9 49 1 0 34 78 1 6 35 79 1 0 35 80 1 0 35 81 1 0 36 82 1 1 37 83 1 0 M END