RDKit 3D 91 93 0 0 0 0 0 0 0 0999 V2000 6.7947 4.4377 1.5396 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8956 2.8977 1.2662 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2492 2.6313 0.7548 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7320 1.2799 0.4911 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0588 0.3938 -0.4644 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6989 -0.0475 -0.0567 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0983 -0.9853 -1.1139 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7438 -1.4388 -0.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8131 -0.2862 -0.5055 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4443 -0.7915 -0.0601 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8347 -1.7146 -1.0624 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4862 -2.1890 -0.5832 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4547 -1.0203 -0.4428 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8033 -1.5125 0.0387 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.7052 -0.2580 0.1649 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1691 0.6363 1.1676 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1963 0.1661 1.8856 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5502 1.9246 1.4661 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5562 2.7011 0.9154 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6693 3.8991 1.3827 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4891 2.3452 -0.0959 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4081 3.1570 -0.6123 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3076 2.7240 -1.6125 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0777 3.8130 -2.0284 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9813 3.7075 -2.9276 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7025 4.9511 -1.3299 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.7851 6.3690 -1.1254 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2939 6.6968 -1.4005 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6502 5.5792 -0.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6917 4.5331 -0.3189 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.2999 -2.4159 -0.8549 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5822 -3.6570 -0.3477 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.9607 -4.7184 -0.9899 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0103 -5.8837 -0.2215 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.9549 -5.7463 0.8532 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3589 -5.9687 0.5103 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.6826 -7.3118 0.6237 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4350 -5.3079 -0.3625 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.6721 -5.4730 0.2236 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1074 -3.8288 -0.3944 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.6569 -3.1529 0.6791 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9264 4.9585 0.5842 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5719 4.7181 2.2541 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7788 4.5896 1.9194 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0736 2.7435 0.5055 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6583 2.4038 2.1912 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3575 3.2412 -0.2199 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9846 3.1543 1.4718 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7944 0.7578 1.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8612 1.3407 0.2654 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9142 0.9472 -1.4555 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6781 -0.5014 -0.7502 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7527 -0.7185 0.8636 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9679 0.6944 0.1667 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9397 -0.4003 -2.0656 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7848 -1.8260 -1.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3484 -2.2460 -1.3161 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8846 -1.9352 0.3412 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1378 0.3924 0.3268 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6513 0.2811 -1.4336 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8015 0.0431 0.2281 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6674 -1.3356 0.9107 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4733 -2.5833 -1.3387 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6485 -1.1519 -2.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0691 -2.9674 -1.2593 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6099 -2.6100 0.4566 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0596 -0.1728 0.0923 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6635 -0.7230 -1.5418 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6856 -1.9368 1.0631 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7260 -0.6130 0.3371 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6616 0.1845 -0.8803 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9634 2.4142 2.2693 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5268 1.3239 -0.5331 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4268 6.8874 -1.8339 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9952 6.5552 -0.0638 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0221 7.6867 -1.0479 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0594 6.4346 -2.4278 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4112 6.0678 0.4576 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7249 5.2269 -0.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1969 4.6296 0.6731 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3399 -3.7251 0.7442 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8107 -6.7862 -0.8134 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3288 -5.2062 1.7467 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0618 -5.1929 0.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5794 -6.7461 1.1983 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3015 -5.4559 1.4867 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3404 -7.5625 -0.0468 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3717 -5.6770 -1.4012 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8162 -4.7202 0.8548 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4215 -3.3725 -1.3554 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4781 -2.6466 0.3890 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 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 16 1 0 16 17 2 0 16 18 1 0 18 19 1 0 19 20 2 0 19 21 1 0 21 22 2 0 22 23 1 0 23 24 1 0 24 25 2 0 24 26 1 0 26 27 1 0 27 28 1 0 28 29 1 0 29 30 1 0 14 31 1 0 31 32 1 0 32 33 1 0 33 34 1 0 34 35 1 0 34 36 1 0 36 37 1 0 36 38 1 0 38 39 1 0 38 40 1 0 40 41 1 0 30 22 1 0 40 32 1 0 30 26 1 0 1 42 1 0 1 43 1 0 1 44 1 0 2 45 1 0 2 46 1 0 3 47 1 0 3 48 1 0 4 49 1 0 4 50 1 0 5 51 1 0 5 52 1 0 6 53 1 0 6 54 1 0 7 55 1 0 7 56 1 0 8 57 1 0 8 58 1 0 9 59 1 0 9 60 1 0 10 61 1 0 10 62 1 0 11 63 1 0 11 64 1 0 12 65 1 0 12 66 1 0 13 67 1 0 13 68 1 0 14 69 1 1 15 70 1 0 15 71 1 0 18 72 1 0 21 73 1 0 27 74 1 0 27 75 1 0 28 76 1 0 28 77 1 0 29 78 1 0 29 79 1 0 30 80 1 1 32 81 1 1 34 82 1 6 35 83 1 0 35 84 1 0 35 85 1 0 36 86 1 1 37 87 1 0 38 88 1 6 39 89 1 0 40 90 1 6 41 91 1 0 M END