RDKit 3D 110112 0 0 0 0 0 0 0 0999 V2000 10.7700 3.5558 0.5129 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4033 3.2918 -0.0966 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4751 1.9589 -0.8279 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8318 0.8589 0.1346 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9081 -0.4758 -0.5786 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2390 -1.5944 0.3442 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1886 -1.8177 1.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8531 -2.2172 0.7719 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8587 -2.4755 1.8558 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4887 -1.3504 2.7407 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8162 -0.1885 2.0978 C 0 0 1 0 0 0 0 0 0 0 0 0 6.6004 0.3906 1.1231 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4811 -0.5552 1.4753 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5200 -1.1790 2.4476 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1986 -0.5393 2.0962 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5603 0.5378 1.1306 C 0 0 2 0 0 0 0 0 0 0 0 0 1.9553 0.3359 -0.2508 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3670 -0.9838 -0.8406 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2937 -1.2153 -1.8749 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1949 -0.3079 -1.3930 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.1424 0.7559 -2.4169 C 0 0 2 0 0 0 0 0 0 0 0 0 1.0095 1.5398 -2.6826 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2391 1.6586 -1.9806 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5593 0.9174 -1.7002 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9737 0.2465 -2.9502 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.0882 1.3147 -3.9184 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3186 -0.4000 -3.0003 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6652 -1.4897 -2.0879 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7249 -1.2746 -0.6298 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7040 -0.2174 -0.2005 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1179 -0.4489 -0.5851 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6869 -1.7010 -0.0049 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1348 -1.9103 -0.4049 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0512 -0.8182 0.0194 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1143 -0.6041 1.5068 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0528 0.5026 1.8584 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7438 1.6177 2.5031 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9321 2.4770 2.6704 C 0 0 2 0 0 0 0 0 0 0 0 0 -12.2607 2.6683 4.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9626 1.7279 2.0445 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.4817 0.5347 1.5437 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.1305 -0.3545 0.9371 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5966 0.2887 -0.2320 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9161 0.5870 0.9906 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8380 2.9841 1.4464 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9157 4.6355 0.7113 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5276 3.1640 -0.2164 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6947 3.1666 0.7548 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1616 4.1058 -0.7754 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2530 2.0671 -1.6184 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5121 1.7951 -1.3308 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2177 0.8759 1.0232 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8854 1.0557 0.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6983 -0.4207 -1.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9713 -0.6985 -1.1011 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3332 -2.5206 -0.2588 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2112 -1.4598 0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9971 -0.8997 1.9914 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4839 -2.6131 2.0891 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4887 -1.4429 0.0895 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0051 -3.1678 0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9325 -2.8709 1.3334 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3022 -3.3302 2.4651 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8997 -1.7020 3.6481 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4271 -0.9490 3.2204 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6677 0.5841 2.9015 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0645 0.8148 0.4073 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6863 -1.2833 0.6723 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7375 -0.9798 3.4965 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4164 -2.2758 2.2813 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7027 -0.1124 3.0145 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4705 -1.2719 1.6933 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1920 1.5049 1.5003 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3492 1.1564 -0.8714 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3812 -0.9480 -1.2953 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2772 -1.8076 -0.0969 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6611 -0.8130 -2.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9885 -2.2795 -1.9345 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7202 -0.9348 -1.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3951 0.3088 -3.4118 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5250 1.1542 -3.4457 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4800 2.4332 -2.7359 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0095 2.2164 -1.0486 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3013 0.2499 -0.8525 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3186 1.6420 -1.3389 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2091 -0.4498 -3.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7269 1.9958 -3.5563 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3859 -0.8197 -4.0676 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1154 0.4073 -3.0442 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5993 -2.0498 -2.4147 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8687 -2.3010 -2.2452 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8016 -1.1809 -0.0718 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1720 -2.2516 -0.2059 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3559 0.8054 -0.4888 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6463 -0.1943 0.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7026 0.4380 -0.2633 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1434 -0.5730 -1.6967 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1135 -2.5688 -0.4471 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5474 -1.7722 1.0908 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4755 -2.8501 0.0893 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1890 -2.0594 -1.4989 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8167 0.1649 -0.4404 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0760 -1.0686 -0.3274 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1369 -0.3607 1.9565 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4818 -1.5353 1.9918 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7496 1.8586 2.8552 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7752 3.4453 2.1559 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8295 1.7817 4.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3320 2.7456 4.7405 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8428 3.6113 4.2421 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 11 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 44 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 43 1 0 20 21 1 0 21 22 1 0 21 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 2 0 37 38 1 0 38 39 1 0 38 40 1 0 40 41 1 0 41 42 2 0 44 13 1 0 43 17 1 0 41 36 1 0 1 45 1 0 1 46 1 0 1 47 1 0 2 48 1 0 2 49 1 0 3 50 1 0 3 51 1 0 4 52 1 0 4 53 1 0 5 54 1 0 5 55 1 0 6 56 1 0 6 57 1 0 7 58 1 0 7 59 1 0 8 60 1 0 8 61 1 0 9 62 1 0 9 63 1 0 10 64 1 0 10 65 1 0 11 66 1 1 12 67 1 0 13 68 1 6 14 69 1 0 14 70 1 0 15 71 1 0 15 72 1 0 16 73 1 1 17 74 1 6 18 75 1 0 18 76 1 0 19 77 1 0 19 78 1 0 20 79 1 1 21 80 1 6 22 81 1 0 23 82 1 0 23 83 1 0 24 84 1 0 24 85 1 0 25 86 1 6 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 0 32 99 1 0 33100 1 0 33101 1 0 34102 1 0 34103 1 0 35104 1 0 35105 1 0 37106 1 0 38107 1 6 39108 1 0 39109 1 0 39110 1 0 M END