RDKit 3D 117116 0 0 0 0 0 0 0 0999 V2000 13.4143 1.4591 -0.7412 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2208 0.0879 -0.1973 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9482 -0.2539 0.4486 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7292 -0.2366 -0.3811 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3561 1.1044 -0.9752 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1020 1.0062 -1.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9865 1.6342 -1.6213 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5949 2.6564 -0.6717 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4887 3.1598 0.3412 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2694 3.0786 1.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1066 2.4830 2.2638 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4157 1.2911 3.1742 C 0 0 2 0 0 0 0 0 0 0 0 0 8.2778 1.7063 4.1819 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0560 0.2253 2.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4751 -0.8565 1.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0616 -1.0963 2.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5398 -2.1965 1.6686 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1372 -2.5626 1.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4341 -2.6364 0.5155 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3893 -1.2515 -0.1165 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5764 -0.3429 0.7535 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0086 0.2679 1.7494 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2088 -0.1261 0.4757 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4012 0.6654 1.2565 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.8294 0.0083 1.8046 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7884 -0.3738 1.0263 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6314 -0.8660 0.1734 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3453 -2.0001 0.2793 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2890 -2.3845 -0.8359 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6915 -2.5150 -0.2297 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0932 -1.2466 0.4655 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1626 -0.0200 -0.3282 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1403 0.0834 -1.4311 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5909 -0.0695 -0.9415 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9080 0.9416 0.0951 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2801 0.8457 0.6308 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4626 1.1048 -0.1917 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7859 0.3116 -1.3829 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9494 -1.1671 -1.0957 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2697 -1.9191 -2.3735 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.4182 -3.3801 -2.0156 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.5479 -3.5023 -1.0047 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0506 1.9497 0.5279 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3473 1.7352 -0.7750 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0398 3.0269 -1.5530 P 0 0 0 0 0 5 0 0 0 0 0 0 -0.3651 3.3051 -2.8910 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9340 4.4169 -0.6286 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6740 2.6909 -1.8515 O 0 0 0 0 0 0 0 0 0 0 0 0 14.4619 1.8359 -0.4597 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7229 2.2198 -0.3858 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4502 1.4537 -1.8608 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4543 -0.6524 -1.0468 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0479 -0.1211 0.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8263 0.4281 1.3556 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0058 -1.2918 0.9271 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9070 -0.9817 -1.2319 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8492 -0.6838 0.1505 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4373 1.8579 -0.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1523 1.2952 -1.7635 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1560 0.2454 -2.5823 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1916 1.3194 -2.3905 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6253 2.2883 -0.1966 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1613 3.5712 -1.2651 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4144 3.7143 0.0002 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0406 3.5050 2.2951 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2656 2.1940 1.6425 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6769 3.3030 2.9455 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4458 0.9693 3.6029 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1824 1.1321 4.9605 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1265 0.3229 2.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0472 -1.5739 1.3699 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4023 -0.4732 2.7471 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1743 -2.8846 1.0834 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1236 -3.5800 2.3255 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6423 -1.8185 2.4799 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4065 -3.0133 0.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0174 -3.2530 -0.2318 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3768 -0.8481 -0.3339 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8448 -1.3904 -1.0733 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0257 1.0266 2.1438 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2396 0.8102 2.5436 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5235 -0.7841 2.5847 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8464 -0.3427 -0.7922 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2051 -2.5786 1.1576 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9971 -3.3917 -1.1601 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2401 -1.7066 -1.6809 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3851 -2.7829 -1.0205 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5804 -3.3007 0.5515 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0490 -1.4907 1.0177 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3514 -1.1230 1.3167 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1537 0.2008 -0.8064 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2853 0.8640 0.3654 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0811 1.0975 -1.8686 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0084 -0.6504 -2.2167 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7862 -1.1219 -0.6604 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1744 0.1433 -1.8509 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2168 0.8768 0.9827 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7542 1.9481 -0.3926 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3614 -0.2056 1.0868 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2841 1.4919 1.5817 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3623 0.9803 0.5177 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5707 2.2277 -0.4269 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8801 0.6307 -1.6784 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2650 0.4673 -2.3112 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8777 -1.2530 -0.4632 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0840 -1.6411 -0.6277 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.2190 -1.5184 -2.7793 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4330 -1.7440 -3.0967 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4833 -3.7152 -1.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.6265 -4.0061 -2.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.3437 -2.7677 -1.2367 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.0239 -4.4929 -1.0366 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.0906 -3.3720 -0.0061 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6891 2.5496 1.0475 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9892 2.5799 0.4492 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0741 4.8994 -0.6795 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8098 1.8629 -2.3760 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 2 0 7 8 1 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 1 0 12 13 1 0 12 14 1 0 14 15 2 0 15 16 1 0 16 17 2 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 2 0 21 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 27 28 2 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 37 38 1 0 38 39 1 0 39 40 1 0 40 41 1 0 41 42 1 0 24 43 1 0 43 44 1 0 44 45 1 0 45 46 2 0 45 47 1 0 45 48 1 0 1 49 1 0 1 50 1 0 1 51 1 0 2 52 1 0 2 53 1 0 3 54 1 0 3 55 1 0 4 56 1 0 4 57 1 0 5 58 1 0 5 59 1 0 6 60 1 0 7 61 1 0 8 62 1 0 8 63 1 0 9 64 1 0 10 65 1 0 11 66 1 0 11 67 1 0 12 68 1 1 13 69 1 0 14 70 1 0 15 71 1 0 16 72 1 0 17 73 1 0 18 74 1 0 18 75 1 0 19 76 1 0 19 77 1 0 20 78 1 0 20 79 1 0 24 80 1 1 25 81 1 0 25 82 1 0 27 83 1 0 28 84 1 0 29 85 1 0 29 86 1 0 30 87 1 0 30 88 1 0 31 89 1 0 31 90 1 0 32 91 1 0 32 92 1 0 33 93 1 0 33 94 1 0 34 95 1 0 34 96 1 0 35 97 1 0 35 98 1 0 36 99 1 0 36100 1 0 37101 1 0 37102 1 0 38103 1 0 38104 1 0 39105 1 0 39106 1 0 40107 1 0 40108 1 0 41109 1 0 41110 1 0 42111 1 0 42112 1 0 42113 1 0 43114 1 0 43115 1 0 47116 1 0 48117 1 0 M END