RDKit 3D 98100 0 0 0 0 0 0 0 0999 V2000 4.5835 -4.4068 -5.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7560 -3.5993 -4.3299 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7073 -4.0849 -3.6512 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9607 -3.2639 -2.7653 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3418 -2.5490 -2.0262 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5788 -1.5854 -1.1025 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0136 -0.7925 -0.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6539 0.2086 0.4474 C 0 0 1 0 0 0 0 0 0 0 0 0 0.3447 1.0289 1.0634 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6766 1.0996 -0.3182 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.0714 1.7214 -1.5673 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3238 1.3812 -2.8426 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6726 2.0331 -4.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2835 1.0917 -4.7615 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6125 0.9104 -4.0365 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4167 -0.0158 -4.7607 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8452 0.3179 -0.6289 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0370 1.1099 -0.7192 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.4179 1.6298 0.5557 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9970 0.7088 1.4882 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.2386 0.7730 2.8218 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0411 0.0118 2.7019 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4837 -0.4109 3.9428 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.0690 -0.3103 3.7952 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3165 -0.7831 4.9198 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1722 -0.6069 4.5736 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5094 -1.4349 3.4507 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7850 -1.1035 2.8924 C 0 0 2 0 0 0 0 0 0 0 0 0 2.6739 0.1152 2.1633 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9093 0.5025 1.5312 C 0 0 2 0 0 0 0 0 0 0 0 0 3.6873 1.8526 0.8302 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6861 1.7689 -0.1826 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4009 -0.5739 0.5495 C 0 0 1 0 0 0 0 0 0 0 0 0 5.7046 -0.2465 0.0560 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4836 -1.9297 1.2548 C 0 0 2 0 0 0 0 0 0 0 0 0 4.8074 -2.9468 0.2934 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1715 -2.2602 1.9556 C 0 0 1 0 0 0 0 0 0 0 0 0 3.3293 -3.4910 2.6812 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6540 -2.2443 5.2443 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.0026 -2.6584 6.4495 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1649 -2.4046 5.4141 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.4665 -3.7954 5.6166 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9025 -1.8758 4.1870 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.3127 -2.0302 4.4134 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1136 -0.7312 0.9672 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.8217 -1.5623 1.9011 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8447 -0.6777 -0.3720 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.9863 -2.0125 -0.8900 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1362 0.2407 -1.3822 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.1254 1.0653 -2.0209 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2338 -5.4412 -5.3518 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6247 -4.4225 -4.9387 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5509 -3.9605 -6.2736 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0531 -2.5586 -4.2043 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4028 -5.1213 -3.7611 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1800 -0.3317 1.2346 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7503 0.4675 1.7579 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9569 1.9222 0.3532 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3375 2.5014 -1.3637 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0292 0.5822 -3.0596 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4704 2.3348 -4.7196 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1490 2.9525 -3.7414 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4886 1.4949 -5.7616 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1858 0.1141 -4.9311 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1557 1.8592 -3.9847 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4843 0.5365 -3.0178 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0267 -0.8961 -4.6184 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8493 1.9743 -1.3666 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0035 1.0964 1.6933 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8710 0.3760 3.6227 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9672 1.8055 3.0667 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8090 0.2513 4.7554 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5373 -0.1421 5.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8065 -0.8833 5.4227 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3543 0.4435 4.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5163 -1.0048 3.7057 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6626 0.6637 2.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6105 2.2118 0.3656 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3536 2.6043 1.5536 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8456 1.5430 0.2727 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7296 -0.6530 -0.3141 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9589 -1.0073 -0.5049 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3127 -1.9336 1.9738 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6556 -3.7953 0.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3846 -2.4389 1.2141 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5012 -3.5987 3.1903 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3147 -2.9152 4.4456 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4079 -3.5221 6.6722 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5064 -1.8936 6.3231 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4409 -3.8554 5.5379 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6581 -2.4960 3.3152 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7609 -1.8718 3.5527 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1379 -1.2085 0.8274 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2457 -2.2623 1.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8739 -0.3372 -0.2031 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0964 -2.3425 -1.1169 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6794 -0.3540 -2.1827 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7562 0.4652 -2.4594 H 0 0 0 0 0 0 0 0 0 0 0 0 35 33 1 0 4 3 1 0 33 30 1 0 3 2 2 0 7 8 1 0 2 1 1 0 30 29 1 0 8 10 1 0 29 28 1 0 10 11 1 0 37 38 1 0 11 12 2 0 33 34 1 0 12 13 1 0 35 36 1 0 13 14 1 0 23 43 1 0 43 41 1 0 41 39 1 0 39 25 1 0 25 24 1 0 24 23 1 0 43 44 1 0 39 40 1 0 41 42 1 0 14 15 1 0 23 22 1 0 15 16 1 0 28 37 1 0 8 9 1 0 31 32 1 0 7 6 3 0 37 35 1 0 6 5 1 0 28 27 1 0 5 4 3 0 18 49 1 0 49 47 1 0 47 45 1 0 45 20 1 0 20 19 1 0 19 18 1 0 45 46 1 0 47 48 1 0 49 50 1 0 22 21 1 0 10 17 1 0 26 27 1 0 30 31 1 0 18 17 1 0 20 21 1 0 25 26 1 0 38 86 1 0 28 76 1 1 33 81 1 6 34 82 1 0 35 83 1 1 36 84 1 0 37 85 1 6 30 77 1 1 31 78 1 0 31 79 1 0 32 80 1 0 8 56 1 1 10 58 1 1 11 59 1 0 12 60 1 0 13 61 1 0 13 62 1 0 14 63 1 0 14 64 1 0 15 65 1 0 15 66 1 0 16 67 1 0 9 57 1 0 3 55 1 0 2 54 1 0 1 51 1 0 1 52 1 0 1 53 1 0 18 68 1 6 44 92 1 0 23 72 1 1 39 87 1 6 40 88 1 0 41 89 1 1 42 90 1 0 43 91 1 6 25 73 1 1 26 74 1 0 26 75 1 0 45 93 1 6 46 94 1 0 47 95 1 1 48 96 1 0 49 97 1 6 50 98 1 0 21 70 1 0 21 71 1 0 20 69 1 1 M END