RDKit 3D 106107 0 0 0 0 0 0 0 0999 V2000 13.0077 0.0606 -0.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6743 1.4512 -0.9317 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3531 2.0219 -0.5781 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1523 1.4094 -1.1927 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7824 0.0241 -0.8521 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4701 -0.2399 0.5611 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4058 0.4504 1.2744 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9711 0.2885 0.8938 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5494 0.6931 -0.4447 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1315 0.7414 -0.8286 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3035 -0.4711 -0.7338 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0076 -1.0396 0.5954 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1410 -2.3049 0.4160 C 0 0 1 0 0 0 0 0 0 0 0 0 2.9306 -2.7822 1.7208 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7960 -1.8126 -0.1401 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7527 -2.9095 0.0153 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4233 -2.1592 0.5856 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0513 -0.7548 0.6586 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.3911 0.1186 -0.5030 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0883 -0.3362 -1.7302 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0969 1.5247 -0.2161 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7900 2.1965 0.9112 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2063 2.4975 0.8433 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3399 1.5884 0.7446 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6503 0.6414 1.8204 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.7440 -0.3272 2.1503 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9903 -0.0756 1.5327 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8672 -0.8225 0.2635 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9240 -1.7592 -0.1793 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2802 -1.2294 -0.3313 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9788 -0.8821 0.9177 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3849 -0.3184 0.5935 C 0 0 2 0 0 0 0 0 0 0 0 0 -10.2368 -1.3148 -0.1416 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3674 -0.8273 -1.5415 C 0 0 1 0 0 0 0 0 0 0 0 0 -11.7798 -0.4086 -1.9123 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2725 0.6874 -1.0639 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.4577 2.0723 -1.5953 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5357 0.4641 0.1021 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.5533 0.4271 -1.5931 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2240 1.0126 -2.6398 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.2595 0.7797 -0.2806 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4266 -0.7682 0.6762 O 0 0 0 0 0 0 0 0 0 0 0 0 14.1428 -0.0259 -0.3674 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5548 -0.3593 0.2962 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9480 -0.5964 -1.5136 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5033 2.0996 -0.4878 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8511 1.6462 -2.0523 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3628 3.1044 -0.9377 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2360 2.1205 0.5486 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2714 2.1158 -1.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3820 1.3875 -2.3193 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7119 -0.6096 -1.0803 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0807 -0.3618 -1.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4287 -0.2427 1.1561 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1979 -1.3616 0.5986 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6406 1.5526 1.4581 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4490 0.0624 2.3609 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8481 -0.8729 1.0001 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3630 0.7507 1.7159 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0049 -0.0754 -1.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9988 1.6951 -0.6671 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1223 1.0286 -1.9457 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5923 1.6279 -0.3577 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7513 -1.2593 -1.4384 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3362 -0.2123 -1.2962 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7848 -1.2009 1.3088 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3289 -0.2557 1.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5873 -3.0478 -0.2257 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7352 -2.0514 2.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9686 -1.5663 -1.1946 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4581 -3.2227 -1.0167 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0936 -3.7369 0.6443 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3460 -2.2914 -0.0197 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5973 -2.5177 1.6363 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2419 -0.2343 1.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5003 -0.0628 -0.5666 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2030 0.3375 -2.4012 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0256 1.6766 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1874 2.1780 -1.1498 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4681 1.7129 1.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2423 3.2133 1.0185 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3214 3.2024 -0.0858 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4455 3.3199 1.6527 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2709 2.2895 0.6987 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4297 1.1038 -0.2679 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8951 1.2313 2.7889 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2167 -1.0015 2.7109 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7361 0.7844 1.4145 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1947 -0.7232 2.3733 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8127 -0.0682 -0.6247 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8403 -1.3027 0.2118 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9131 -2.7099 0.4497 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5912 -2.1259 -1.2085 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9620 -1.9321 -0.9001 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2976 -0.3072 -0.9999 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2008 -1.8802 1.4447 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4649 -0.2507 1.5896 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8431 0.0090 1.5492 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2250 -1.4370 0.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7433 -2.3267 -0.0634 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0086 -1.5625 -2.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7059 -0.0227 -2.9667 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4209 -1.3223 -1.8899 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.5263 2.3728 -1.4066 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8124 2.7959 -1.0951 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3374 2.1114 -2.6901 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 13 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 42 1 0 18 19 1 0 19 20 1 0 19 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 25 27 1 0 27 28 1 0 28 29 1 0 29 30 1 0 30 31 1 0 31 32 1 0 32 33 1 0 33 34 1 0 34 35 1 0 35 36 1 0 36 37 1 0 36 38 2 0 34 39 1 0 39 40 2 0 39 41 1 0 42 15 1 0 41 32 1 0 1 43 1 0 1 44 1 0 1 45 1 0 2 46 1 0 2 47 1 0 3 48 1 0 3 49 1 0 4 50 1 0 4 51 1 0 5 52 1 0 5 53 1 0 6 54 1 0 6 55 1 0 7 56 1 0 7 57 1 0 8 58 1 0 8 59 1 0 9 60 1 0 9 61 1 0 10 62 1 0 10 63 1 0 11 64 1 0 11 65 1 0 12 66 1 0 12 67 1 0 13 68 1 6 14 69 1 0 15 70 1 6 16 71 1 0 16 72 1 0 17 73 1 0 17 74 1 0 18 75 1 1 19 76 1 6 20 77 1 0 21 78 1 0 21 79 1 0 22 80 1 0 22 81 1 0 23 82 1 0 23 83 1 0 24 84 1 0 24 85 1 0 25 86 1 1 26 87 1 0 27 88 1 0 27 89 1 0 28 90 1 0 28 91 1 0 29 92 1 0 29 93 1 0 30 94 1 0 30 95 1 0 31 96 1 0 31 97 1 0 32 98 1 1 33 99 1 0 33100 1 0 34101 1 6 35102 1 0 35103 1 0 37104 1 0 37105 1 0 37106 1 0 M END