RDKit 3D 104112 0 0 0 0 0 0 0 0999 V2000 -0.6575 5.7569 3.8521 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2551 4.8068 3.4002 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1699 3.7111 2.6135 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3777 3.6801 2.3764 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7806 2.7463 2.1588 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4518 1.5808 1.3445 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8312 0.8943 1.1368 C 0 0 2 0 0 0 0 0 0 0 0 0 2.6820 0.9028 2.3254 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3032 1.6998 -0.0303 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1212 1.3084 -0.9444 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1028 2.0280 -2.0908 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9706 2.2233 -3.1018 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5663 3.1134 -4.2383 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0655 1.6612 -3.0526 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0711 1.6826 -0.0199 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.3318 3.1497 -0.4397 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3156 0.9435 -0.3749 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.2076 1.8121 -1.0803 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2375 1.4253 -2.3844 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.5104 2.5133 -3.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0444 0.2887 -2.6184 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3812 -0.7432 -1.8635 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.2242 -1.8734 -2.8395 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8477 -2.2326 -3.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6436 -3.2061 -3.9277 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2169 -1.5507 -2.6542 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0652 -0.9319 -1.3653 C 0 0 1 0 0 0 0 0 0 0 0 0 1.3163 -0.1729 -0.9800 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3856 -0.4431 -1.8449 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8927 -1.6426 -2.2185 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0469 -1.7113 -3.1448 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3934 -2.6892 -1.7871 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6541 -0.4665 0.4814 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8941 -1.0883 0.5577 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1543 -2.2714 1.2431 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2201 -2.8233 1.8343 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5476 -2.7832 1.2101 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5803 -2.0075 0.4511 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0097 -3.0505 2.6061 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8902 -4.1252 1.7251 C 0 0 2 0 0 0 0 0 0 0 0 0 6.1730 -4.7271 1.1694 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1362 -0.0881 -1.4743 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.9984 0.8161 -2.5789 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4161 -1.1050 -0.8545 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.7427 -1.2007 -1.6634 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2532 -2.3238 -0.1034 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2354 -3.0329 -0.1993 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2819 -2.7812 0.8126 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1928 -3.8724 1.6932 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3681 -3.9576 2.3966 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1333 -2.9855 1.9798 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5328 -2.2661 1.0449 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5623 0.0973 0.0448 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1420 0.3271 0.6732 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.4475 0.9838 1.8381 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4920 0.5329 3.1262 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8372 1.3340 4.3213 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2090 -0.6846 3.2940 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4929 5.8147 3.1359 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0997 5.4804 4.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1140 6.7358 3.9277 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6981 3.3192 1.7898 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2259 2.3143 3.1382 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0505 0.7928 1.9764 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1102 1.9206 2.4917 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1848 0.5412 3.2494 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5708 0.2426 2.2256 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3940 2.7623 0.0757 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2309 1.1951 -0.3924 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4230 3.7260 -4.5854 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1193 2.4890 -5.0258 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7943 3.8255 -3.8932 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2330 3.1605 -1.5438 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4045 3.4011 -0.2827 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3911 3.8432 -0.0325 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3136 3.1565 -2.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8624 2.0191 -4.3156 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6203 3.1205 -3.5181 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7464 -1.6843 -3.8243 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7358 -2.7822 -2.4523 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0451 -1.7255 -0.6424 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7837 -1.3498 -4.1669 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3694 -2.7762 -3.2927 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9125 -1.1276 -2.7939 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8578 -1.0467 0.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6077 -2.3423 -0.6214 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5782 -2.1882 0.8562 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3980 -0.9046 0.4889 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0853 -4.8257 1.9753 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0557 -4.1041 1.3678 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0679 -4.8679 0.0669 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2830 -5.7569 1.6048 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5424 -1.1523 -2.7516 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3830 -0.3383 -1.4297 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2081 -2.1872 -1.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3220 -4.4997 1.7596 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6420 -4.6822 3.1604 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0493 -1.4124 0.5922 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8327 0.9551 -0.6014 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2742 -0.0434 0.8711 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8143 -0.7261 0.8533 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6564 0.7849 4.8587 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2703 2.2952 3.9906 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9984 1.4463 5.0214 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 3 5 1 0 5 6 1 0 6 7 1 0 7 8 1 1 7 9 1 0 9 10 1 0 10 11 1 6 11 12 1 0 12 13 1 0 12 14 2 0 10 15 1 0 15 16 1 6 15 17 1 0 17 18 1 6 18 19 1 0 19 20 1 6 19 21 1 0 22 21 1 6 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 6 29 30 1 0 30 31 1 0 30 32 2 0 28 33 1 0 33 34 1 0 34 35 1 0 35 36 2 0 37 35 1 1 37 38 1 0 37 39 1 0 39 40 1 0 40 41 1 0 27 42 1 0 42 43 1 6 22 44 1 0 44 45 1 0 44 53 1 0 53 54 1 0 54 55 1 0 55 56 1 0 56 57 1 0 56 58 2 0 44 46 1 1 46 47 2 0 46 48 1 0 48 52 2 0 52 51 1 0 51 50 1 0 50 49 2 0 15 6 1 0 42 17 1 0 49 48 1 0 33 7 1 0 40 37 1 0 28 10 1 0 54 17 1 0 43 19 1 0 42 22 1 0 1 59 1 0 1 60 1 0 1 61 1 0 5 62 1 0 5 63 1 0 6 64 1 1 8 65 1 0 8 66 1 0 8 67 1 0 9 68 1 0 9 69 1 0 13 70 1 0 13 71 1 0 13 72 1 0 16 73 1 0 16 74 1 0 16 75 1 0 20 76 1 0 20 77 1 0 20 78 1 0 23 79 1 0 23 80 1 0 27 81 1 1 31 82 1 0 31 83 1 0 31 84 1 0 33 85 1 1 38 86 1 0 38 87 1 0 38 88 1 0 40 89 1 1 41 90 1 0 41 91 1 0 41 92 1 0 45 93 1 0 45 94 1 0 45 95 1 0 53 99 1 0 53100 1 0 54101 1 1 57102 1 0 57103 1 0 57104 1 0 52 98 1 0 50 97 1 0 49 96 1 0 M END