RDKit 3D 95 98 0 0 0 0 0 0 0 0999 V2000 -3.1107 4.3796 1.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3488 3.2589 0.8246 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2161 3.3921 -0.4131 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7236 2.0527 1.3297 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9810 0.8848 0.4419 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.0943 -0.1042 1.0278 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8347 -1.4615 0.6258 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.0221 -2.2976 0.7108 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1287 -3.3582 1.5863 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3700 -4.2050 1.6512 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1431 -3.5971 2.3375 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2343 -1.7734 -0.7239 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.2305 -1.2574 -1.8153 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9456 -1.1452 -1.0629 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.5925 -1.5259 -2.5486 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7506 -0.7972 -2.5699 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4636 -1.4167 -1.3623 C 0 0 1 0 0 0 0 0 0 0 0 0 1.9999 -2.7234 -1.9178 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5692 -0.5034 -1.0195 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4621 0.8450 -1.7139 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7869 1.5299 -1.5673 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2369 1.6510 -0.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3809 1.0969 0.7481 C 0 0 2 0 0 0 0 0 0 0 0 0 4.1592 1.1102 2.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6447 2.5498 2.2554 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7382 2.7515 1.2757 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7715 3.2560 1.6341 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5365 2.3311 -0.1112 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5374 3.6111 -0.9612 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6417 1.4673 -0.6727 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9486 -0.3251 0.3903 C 0 0 2 0 0 0 0 0 0 0 0 0 4.1857 -1.1642 0.7724 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9039 -0.7108 1.3914 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5173 -0.7549 0.8278 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3282 -1.5986 -0.3877 C 0 0 1 0 0 0 0 0 0 0 0 0 0.2461 -3.0516 0.0315 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4497 -3.4673 0.6563 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4694 0.7253 0.6462 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1976 -0.0506 -0.3939 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0298 2.1740 0.4896 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8175 0.4261 1.9585 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0549 4.5090 2.3533 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3503 4.0374 2.5371 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7964 5.3017 1.2628 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8001 1.2883 -0.5439 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0725 0.4159 1.1129 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3667 -0.1434 2.1513 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1909 -1.9283 1.3904 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1069 -3.7901 0.9572 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0517 -5.2443 1.3521 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7107 -4.2770 2.6929 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2875 -2.8726 -0.8365 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2171 -1.6180 -1.5726 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0550 -0.2425 -2.0963 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9252 -1.8774 -2.7252 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0385 -0.0552 -1.0889 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5454 -2.5888 -2.6869 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2297 -0.9481 -3.2414 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2331 -1.0124 -3.5168 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4749 0.2648 -2.3915 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6817 -3.2574 -1.2485 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6936 -2.3808 -2.7633 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2708 -3.3464 -2.4272 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5062 -0.9254 -1.5192 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3797 0.6713 -2.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6735 1.4838 -1.3091 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3715 1.9157 -2.3911 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5027 1.7557 0.8871 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5916 0.8350 2.9183 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0909 0.5087 1.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9837 2.6967 3.3002 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7634 3.1887 2.0498 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7568 3.3679 -2.0223 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5626 4.1218 -0.8779 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3237 4.2946 -0.5992 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2541 0.6670 -1.3423 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1630 0.9531 0.1717 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3679 2.0516 -1.2852 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1106 -0.7364 0.3904 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1917 -1.3050 1.8939 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0533 -2.1598 0.3452 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1086 -1.6653 1.9083 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8341 0.0330 2.2457 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1373 -1.0512 1.6579 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2208 0.2958 0.5206 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1421 -3.7449 -0.8328 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5087 -3.2479 0.8119 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2700 -4.3117 1.1308 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2734 0.2994 -0.5057 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3145 -1.1336 -0.1872 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7948 0.1487 -1.4307 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1458 2.0228 0.5574 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8169 2.5185 -0.5208 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7171 2.8072 1.3162 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8371 1.2059 2.5529 H 0 0 0 0 0 0 0 0 0 0 0 0 13 12 1 0 12 7 1 0 7 6 1 0 6 5 1 0 5 4 1 0 4 2 1 0 2 1 1 0 2 3 2 0 5 38 1 0 38 39 1 0 38 40 1 0 38 41 1 0 7 8 1 0 8 9 1 0 9 10 1 0 9 11 2 0 12 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 6 17 19 1 0 19 20 1 0 20 21 1 0 21 22 2 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 26 27 2 0 26 28 1 0 28 29 1 0 28 30 1 0 23 31 1 0 31 32 1 1 31 33 1 0 33 34 1 0 34 35 1 0 35 36 1 1 36 37 1 0 35 14 1 0 35 17 1 0 31 19 1 0 28 22 1 0 13 53 1 0 13 54 1 0 13 55 1 0 12 52 1 1 7 48 1 1 6 46 1 0 6 47 1 0 5 45 1 6 1 42 1 0 1 43 1 0 1 44 1 0 39 89 1 0 39 90 1 0 39 91 1 0 40 92 1 0 40 93 1 0 40 94 1 0 41 95 1 0 10 49 1 0 10 50 1 0 10 51 1 0 14 56 1 6 15 57 1 0 15 58 1 0 16 59 1 0 16 60 1 0 18 61 1 0 18 62 1 0 18 63 1 0 19 64 1 6 20 65 1 0 20 66 1 0 21 67 1 0 23 68 1 1 24 69 1 0 24 70 1 0 25 71 1 0 25 72 1 0 29 73 1 0 29 74 1 0 29 75 1 0 30 76 1 0 30 77 1 0 30 78 1 0 32 79 1 0 32 80 1 0 32 81 1 0 33 82 1 0 33 83 1 0 34 84 1 0 34 85 1 0 36 86 1 0 36 87 1 0 37 88 1 0 M END