RDKit 3D 98103 0 0 0 0 0 0 0 0999 V2000 10.1083 -0.6435 2.6504 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5172 -0.7386 1.2807 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5430 -0.4829 0.3266 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2379 -0.1481 0.6372 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2898 0.0998 -0.3198 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9332 0.4492 0.1057 C 0 0 1 0 0 0 0 0 0 0 0 0 5.8499 1.4252 1.0646 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4961 1.6605 1.2061 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8941 1.5259 -0.1524 C 0 0 2 0 0 0 0 0 0 0 0 0 2.9559 0.3401 -0.2498 C 0 0 1 0 0 0 0 0 0 0 0 0 1.5626 0.8054 -0.0731 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4994 -0.0143 -0.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8047 0.3838 -0.3317 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8094 -0.4906 -0.7676 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4569 -1.7160 -1.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1367 1.5987 0.2296 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4404 1.9226 0.3457 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3235 1.6565 1.4247 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.1943 0.6645 1.1262 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5075 0.7500 1.3243 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.2075 0.8835 -0.0139 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0149 -0.1737 -0.8651 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4778 -1.3896 -0.4467 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.3894 -2.2570 -0.3014 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7832 -3.4532 0.3065 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.6322 -4.4214 0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5054 -3.8572 0.7445 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9943 -4.0480 -0.3749 C 0 0 1 0 0 0 0 0 0 0 0 0 -8.1340 -3.8535 0.4076 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2498 -3.3967 -1.7207 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.1456 -3.4796 -2.5596 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4717 -1.9195 -1.4508 C 0 0 1 0 0 0 0 0 0 0 0 0 -8.7755 -1.7344 -0.9847 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0322 1.7380 2.3089 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.7904 1.1702 3.3280 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9484 2.5731 2.9441 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.4121 3.6735 3.6122 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0191 2.9402 1.7737 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.1904 3.9813 2.1173 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1216 2.4190 0.6405 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3123 3.6456 1.2101 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7136 4.4873 1.6297 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2091 2.0121 0.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1351 -0.1981 -1.4992 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4875 -0.0961 -1.8148 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0618 1.0132 -0.9978 C 0 0 2 0 0 0 0 0 0 0 0 0 7.6703 0.0072 -1.6406 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9685 -0.3255 -2.0036 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3615 -0.4205 -3.3378 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4257 -0.1731 -4.3539 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8745 -0.5628 -0.9985 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1728 -0.8951 -1.3552 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3806 -1.4705 2.8538 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5879 0.3147 2.8486 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9921 -0.7994 3.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9589 -0.0817 1.6916 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3850 -0.4692 0.4654 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2920 2.6482 1.6777 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0650 0.8972 1.9146 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4906 2.4602 -0.5416 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2282 -0.3653 0.5729 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7789 -0.9685 -0.9249 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0999 -2.4706 -0.6073 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7224 -1.5321 -2.1618 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3637 -2.1408 -1.8789 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7257 1.2830 2.3122 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8416 -0.2579 1.7276 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3017 1.0036 0.1361 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8760 1.7987 -0.5696 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9951 -1.3841 0.5474 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9419 -3.3387 1.3999 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8369 -5.4277 0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3793 -4.4462 -0.9789 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7798 -3.2451 1.4771 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8614 -5.1262 -0.5268 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9677 -3.9340 -0.0884 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1601 -3.7871 -2.1887 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9301 -4.4131 -2.8057 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3064 -1.3809 -2.4074 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1538 -0.8743 -1.3452 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7016 2.4421 1.7696 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4622 1.3790 4.2339 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3424 1.9191 3.6025 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3140 4.4609 2.9963 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7200 3.2395 0.9458 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9433 4.4403 1.2605 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4271 4.6540 0.7908 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2131 4.0783 2.5061 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2400 5.4734 1.8826 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0157 2.6721 0.8174 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9390 -1.0777 -1.5003 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5595 0.0482 -2.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5051 1.8411 -1.5455 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9752 0.1897 -2.4444 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8922 -0.2611 -5.3575 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0598 0.8849 -4.2736 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5546 -0.8385 -4.3245 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5002 -0.9745 -2.3041 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 4 5 1 0 5 47 2 0 47 48 1 0 48 49 1 0 49 50 1 0 48 51 2 0 51 52 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 46 1 0 46 45 1 0 45 44 1 0 44 10 1 0 10 11 1 0 11 12 2 0 12 13 1 0 13 14 1 0 14 15 1 0 13 16 2 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 25 28 1 0 28 29 1 0 28 30 1 0 30 31 1 0 30 32 1 0 32 33 1 0 20 34 1 0 34 35 1 0 34 36 1 0 36 37 1 0 36 38 1 0 38 39 1 0 16 40 1 0 40 41 1 0 41 42 1 0 40 43 2 0 51 3 1 0 46 6 1 0 43 11 1 0 10 9 1 0 38 18 1 0 32 23 1 0 1 53 1 0 1 54 1 0 1 55 1 0 4 56 1 0 47 94 1 0 50 95 1 0 50 96 1 0 50 97 1 0 52 98 1 0 6 57 1 1 8 58 1 0 8 59 1 0 9 60 1 6 46 93 1 6 45 91 1 0 45 92 1 0 10 61 1 1 12 62 1 0 15 63 1 0 15 64 1 0 15 65 1 0 18 66 1 1 20 67 1 1 21 68 1 0 21 69 1 0 23 70 1 1 25 71 1 1 26 72 1 0 26 73 1 0 27 74 1 0 28 75 1 6 29 76 1 0 30 77 1 6 31 78 1 0 32 79 1 6 33 80 1 0 34 81 1 6 35 82 1 0 36 83 1 1 37 84 1 0 38 85 1 6 39 86 1 0 42 87 1 0 42 88 1 0 42 89 1 0 43 90 1 0 M END