RDKit 3D 98103 0 0 0 0 0 0 0 0999 V2000 7.4507 -0.5835 4.1302 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0510 -0.6143 2.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8317 -1.9236 2.0389 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8966 0.4884 2.0356 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4995 0.5868 0.6048 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8748 1.9185 0.3782 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9859 1.9872 -0.8427 C 0 0 2 0 0 0 0 0 0 0 0 0 5.9819 2.0553 -2.0266 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3307 3.1873 -0.9162 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1874 0.7565 -0.9260 C 0 0 1 0 0 0 0 0 0 0 0 0 4.3727 -0.0082 0.4066 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2553 -1.0164 0.4118 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4438 -0.7229 -0.8379 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1934 -1.4049 -1.9582 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9947 -1.0916 -0.7485 C 0 0 2 0 0 0 0 0 0 0 0 0 0.6622 -2.2531 -1.6613 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7350 -2.6841 -1.5666 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6852 -1.7520 -1.5808 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2675 -0.3626 -1.6845 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.3653 0.5336 -1.2323 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5429 0.1208 -0.7417 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4521 1.0697 -0.3659 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4968 0.9983 0.5120 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.4890 0.0945 0.2644 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1871 -0.1192 1.4520 C 0 0 2 0 0 0 0 0 0 0 0 0 -8.2519 -1.1824 1.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1827 -0.8267 0.3153 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8564 1.1301 1.9608 C 0 0 1 0 0 0 0 0 0 0 0 0 -8.2610 0.8718 3.2815 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8954 2.3028 2.0209 C 0 0 2 0 0 0 0 0 0 0 0 0 -7.6524 3.4535 2.2372 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1696 2.3637 0.7039 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.2701 3.4010 0.6257 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8376 -1.2964 -0.6172 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6306 -1.7580 0.2084 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1339 -2.1807 -1.5395 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6340 -2.0238 -2.9681 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2583 -3.6415 -1.1699 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0115 -0.0132 -0.8690 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.6080 0.2835 0.5247 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5134 1.2239 -1.5053 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1802 2.2005 -1.6201 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9419 1.3015 -2.0321 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7156 0.7906 -0.9006 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2946 1.5127 0.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6374 -0.4910 0.3767 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8600 0.1510 4.7186 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2467 -1.5753 4.6301 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5327 -0.4085 4.2676 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3118 -1.9641 1.0342 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7598 -2.1988 1.9492 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2789 -2.7642 2.6352 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0733 1.4457 2.5573 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4202 0.4374 -0.0007 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7237 2.6435 0.1862 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4049 2.3169 1.3002 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4218 2.0039 -2.9836 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5654 2.9880 -1.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6787 1.1971 -1.9721 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3339 3.6260 -1.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6621 0.1101 -1.6846 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2501 0.6369 1.2731 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6780 -1.0832 1.3281 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7516 -2.0294 0.3073 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2096 -1.7954 -1.6417 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7290 -2.3378 -2.3324 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3279 -0.7850 -2.8621 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8934 -1.5520 0.2852 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2575 -3.1697 -1.3576 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8274 -1.9865 -2.7336 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0631 -3.7216 -1.4853 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0395 -0.0560 -2.7414 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2781 1.6321 -1.2804 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0811 0.7549 1.5343 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5191 -0.4771 2.2782 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7960 -2.1746 1.0849 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8100 -1.2863 2.2351 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9322 -1.3089 -0.5086 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7695 1.3899 1.3963 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0778 1.3977 3.5101 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1942 2.1224 2.8561 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3644 4.1335 1.5769 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9538 2.4057 -0.0996 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8269 3.3439 -0.2577 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3290 -1.0730 -3.4238 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7194 -2.1499 -3.0586 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1604 -2.8400 -3.5617 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9523 -4.2371 -2.0311 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6896 -3.9066 -0.2788 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3582 -3.8214 -1.0472 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6663 1.3543 0.7124 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0391 -0.1954 1.3234 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5671 -0.2492 0.6808 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9625 0.7327 -2.9623 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1942 2.3395 -2.2386 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4675 2.2267 0.1467 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1288 0.8559 1.2256 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0965 2.2183 0.7379 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 2 3 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 7 9 1 1 7 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 6 13 15 1 0 15 16 1 0 16 17 1 0 17 18 2 0 18 19 1 0 19 20 1 0 20 21 2 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 21 34 1 0 34 35 2 0 34 36 1 0 36 37 1 0 36 38 1 0 19 39 1 0 39 40 1 1 39 41 1 0 41 42 2 0 41 43 1 0 43 44 1 0 44 45 1 1 11 46 1 0 46 5 1 0 44 10 1 0 44 13 1 0 39 15 1 0 36 18 1 0 32 23 1 0 1 47 1 0 1 48 1 0 1 49 1 0 3 50 1 0 3 51 1 0 3 52 1 0 4 53 1 0 5 54 1 6 6 55 1 0 6 56 1 0 8 57 1 0 8 58 1 0 8 59 1 0 9 60 1 0 10 61 1 6 11 62 1 1 12 63 1 0 12 64 1 0 14 65 1 0 14 66 1 0 14 67 1 0 15 68 1 1 16 69 1 0 16 70 1 0 17 71 1 0 19 72 1 6 20 73 1 0 23 74 1 1 25 75 1 1 26 76 1 0 26 77 1 0 27 78 1 0 28 79 1 6 29 80 1 0 30 81 1 1 31 82 1 0 32 83 1 6 33 84 1 0 37 85 1 0 37 86 1 0 37 87 1 0 38 88 1 0 38 89 1 0 38 90 1 0 40 91 1 0 40 92 1 0 40 93 1 0 43 94 1 0 43 95 1 0 45 96 1 0 45 97 1 0 45 98 1 0 M END