RDKit 3D 95 96 0 0 0 0 0 0 0 0999 V2000 9.5163 0.3917 0.3522 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2458 0.4572 -0.1244 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3791 1.2148 0.5905 C 0 0 1 0 0 0 0 0 0 0 0 0 7.1178 2.4878 -0.2146 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0630 0.5204 0.9653 C 0 0 2 0 0 0 0 0 0 0 0 0 6.5022 -0.6728 1.8305 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4306 -0.0508 -0.2508 C 0 0 2 0 0 0 0 0 0 0 0 0 5.2561 1.0841 -1.1244 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0171 -0.5594 -0.1136 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7936 -1.6296 0.8794 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6386 -1.1429 -1.4881 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7430 -0.1620 -2.4725 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2776 -1.7762 -1.4745 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2052 -0.8056 -1.1361 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1929 -1.4047 -1.0908 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.4488 -1.9807 -2.4513 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1361 -0.2125 -0.8130 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.6618 0.3501 0.5027 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0535 1.5988 0.5223 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0616 2.6765 -0.2103 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0347 2.7726 -1.2554 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3229 2.9527 -1.0724 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9887 3.0908 0.2255 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4490 3.4407 0.1074 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.9112 2.9844 -1.1222 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2249 2.7637 1.2156 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.4938 3.2246 1.4853 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4257 2.0314 0.7642 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.5097 0.7291 1.5549 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.8373 0.9319 2.7635 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8084 -0.4085 0.8332 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.8816 -1.4989 0.6647 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6879 -0.9371 1.6304 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9400 -1.9888 1.3606 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8316 -2.3462 2.3535 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1474 -2.7965 0.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9478 -2.4550 -1.0568 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2466 -3.4884 -2.1164 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4154 -1.1407 -1.5012 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0178 -0.7536 -2.5898 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4603 -0.4850 -0.8512 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9952 1.4051 0.4124 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7189 -0.1548 1.2614 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1376 -0.1200 -0.4526 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9142 1.5933 1.5085 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1811 2.3288 -1.2925 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8573 3.2865 0.0998 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1426 2.8792 0.1263 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4714 1.2546 1.5266 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0451 -0.6169 2.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3412 -1.6300 1.3505 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6048 -0.6237 2.0566 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0861 -0.7693 -0.7419 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4221 1.5610 -0.8433 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3373 0.2846 0.0596 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6892 -1.8657 0.9838 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2728 -2.5980 0.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0791 -1.3828 1.9232 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4176 -1.9004 -1.7142 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0563 0.5125 -2.4811 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2871 -2.6184 -0.7555 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1553 -2.1866 -2.5237 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4533 -0.2683 -0.2124 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2088 -0.0020 -1.9358 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2672 -2.1223 -0.3084 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2267 -2.8206 -2.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4217 -1.2070 -3.2453 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4728 -2.3947 -2.4667 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7638 0.5033 -1.6129 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1173 -0.4837 1.0243 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5832 0.4389 1.1543 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8734 1.7111 1.2988 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6569 3.5437 -0.0373 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7372 2.7474 -2.3344 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9977 3.0091 -1.9524 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9201 2.2254 0.8923 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5111 3.9329 0.8199 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5624 4.5461 0.1134 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6456 2.0417 -1.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6291 2.4788 2.0973 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6974 2.0405 -0.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5764 0.4963 1.7301 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2446 1.6969 3.2071 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5701 -0.0412 -0.1591 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0761 -2.0219 1.6063 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7960 -0.9185 0.3411 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6427 -2.1474 -0.1896 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4556 -0.3807 2.5489 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9567 -1.7298 2.0901 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1493 -2.0040 3.3604 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5703 -3.3963 2.3224 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4788 -3.8511 0.3644 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1356 -4.1066 -1.8306 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4395 -2.9841 -3.0781 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3691 -4.1785 -2.2366 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 3 5 1 0 5 6 1 0 5 7 1 0 7 8 1 0 7 9 1 0 9 10 1 0 9 11 1 0 11 12 1 0 11 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 15 17 1 0 17 18 1 0 18 19 1 0 19 20 2 0 20 21 1 0 21 22 2 0 22 23 1 0 23 24 1 0 24 25 1 0 24 26 1 0 26 27 1 0 27 28 1 0 28 29 1 0 29 30 1 0 29 31 1 0 31 32 1 0 31 33 1 0 33 34 2 0 34 35 1 0 34 36 1 0 36 37 2 0 37 38 1 0 37 39 1 0 39 40 2 0 39 41 1 0 41 17 1 0 28 26 1 0 1 42 1 0 1 43 1 0 1 44 1 0 3 45 1 1 4 46 1 0 4 47 1 0 4 48 1 0 5 49 1 1 6 50 1 0 6 51 1 0 6 52 1 0 7 53 1 6 8 54 1 0 9 55 1 1 10 56 1 0 10 57 1 0 10 58 1 0 11 59 1 6 12 60 1 0 13 61 1 0 13 62 1 0 14 63 1 0 14 64 1 0 15 65 1 1 16 66 1 0 16 67 1 0 16 68 1 0 17 69 1 6 18 70 1 0 18 71 1 0 19 72 1 0 20 73 1 0 21 74 1 0 22 75 1 0 23 76 1 0 23 77 1 0 24 78 1 6 25 79 1 0 26 80 1 1 28 81 1 6 29 82 1 1 30 83 1 0 31 84 1 6 32 85 1 0 32 86 1 0 32 87 1 0 33 88 1 0 35 89 1 0 35 90 1 0 35 91 1 0 36 92 1 0 38 93 1 0 38 94 1 0 38 95 1 0 M END