RDKit 3D 98104 0 0 0 0 0 0 0 0999 V2000 -3.5555 0.6176 5.8956 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3527 1.2654 6.5682 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1152 1.3068 5.6643 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0009 2.1310 6.3044 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5992 -0.0944 5.3951 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 -0.7864 6.2069 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9102 -0.4710 4.1220 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4588 -1.7788 3.7119 C 0 0 2 0 0 0 0 0 0 0 0 0 0.9954 -1.6620 3.1726 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1487 -0.8898 1.8238 C 0 0 2 0 0 0 0 0 0 0 0 0 0.9088 0.5161 2.0639 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9632 1.2359 2.5408 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5896 2.6828 2.6381 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0628 0.7827 2.8190 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1656 -1.3979 0.6935 C 0 0 2 0 0 0 0 0 0 0 0 0 0.6811 -2.7659 0.1886 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0591 -0.3192 -0.4731 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2202 0.2552 -1.1429 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1856 -0.7757 -1.4010 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4914 -0.3849 -1.4445 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3718 -1.5726 -1.6817 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8920 0.7616 -1.3116 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9620 1.0262 -2.4469 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4029 1.7352 -2.5188 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.5748 2.7880 -1.3939 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5792 2.4661 -3.9111 C 0 0 2 0 0 0 0 0 0 0 0 0 0.4502 3.5294 -4.1983 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3870 4.9200 -3.8833 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5451 5.4859 -4.3596 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3167 4.5462 -4.9595 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6472 3.3702 -4.8711 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9022 3.0601 -4.0139 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0204 2.3749 -3.6417 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1398 2.8582 -3.7384 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8340 1.0287 -3.0455 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.9198 0.1925 -3.7439 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4865 0.6439 -2.4313 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.2765 -0.5957 -1.4671 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.0062 -1.8532 -2.3358 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5956 -0.8336 -0.6205 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.9515 0.4247 0.0144 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2832 0.6830 0.1454 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4799 1.9129 0.9766 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1871 0.0403 -0.3659 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3749 -1.8847 0.4891 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.4633 -2.0132 1.4315 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9087 -2.1011 2.7792 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3950 -2.3371 2.6184 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.1745 -3.8583 2.4834 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2097 -1.4979 1.3655 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.4329 0.6876 6.5465 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3756 -0.4426 5.6942 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7939 1.1152 4.9502 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6276 2.2880 6.8544 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1307 0.7225 7.4952 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3706 1.7810 4.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9043 2.1135 5.6854 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3076 3.1745 6.4256 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2717 1.7406 7.2918 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4807 -2.4556 4.5755 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6034 -1.1597 3.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4146 -2.6669 3.0579 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1769 -1.0111 1.4584 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6225 2.7880 3.1365 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5511 3.1197 1.6373 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3383 3.2109 3.2352 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2213 -2.7025 -0.7555 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1196 -3.4908 0.0306 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3797 -3.2305 0.8913 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4268 0.5452 0.0859 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6548 0.9582 -0.4201 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1219 -2.0332 -2.6407 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4163 -1.2496 -1.7108 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2515 -2.2905 -0.8664 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7757 1.7502 -2.5693 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0619 0.3385 -3.2981 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7023 2.3674 -0.3985 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4612 3.4117 -1.5515 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2934 3.4539 -1.3439 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4990 1.7454 -4.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4134 5.4430 -3.3774 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9451 6.4904 -4.3599 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1436 2.5226 -5.3242 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7488 0.5646 -2.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8334 -2.0454 -3.0293 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9149 -2.7703 -1.7598 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0972 -1.7393 -2.9345 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4060 -1.1685 -1.2782 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5488 2.0667 1.1493 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0770 2.7821 0.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9894 1.7873 1.9456 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2487 -2.8685 0.0293 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4252 -2.9003 3.3197 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1440 -1.1530 3.2726 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1278 -4.1274 2.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4914 -4.3655 3.4033 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7552 -4.2991 1.6675 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4301 -0.4684 1.7001 H 0 0 0 0 0 0 0 0 0 0 0 0 38 39 1 6 8 7 1 0 8 48 1 0 10 11 1 0 48 50 1 0 45 46 1 0 15 10 1 0 17 70 1 1 40 41 1 0 15 50 1 0 24 25 1 1 2 1 1 0 48 47 1 0 47 46 1 0 7 5 1 0 50 98 1 1 5 6 2 0 11 12 1 0 42 43 1 0 12 13 1 0 15 17 1 0 12 14 2 0 50 45 1 0 18 19 1 0 45 40 1 0 19 20 1 0 40 38 1 0 20 21 1 0 17 38 1 0 20 22 2 0 24 37 1 0 3 4 1 0 9 8 1 0 5 3 1 0 17 18 1 0 38 37 1 0 24 26 1 0 37 35 1 0 35 33 1 0 33 32 1 0 32 26 1 0 24 23 1 0 33 34 2 0 35 36 1 0 23 18 1 0 37 36 1 6 3 2 1 0 27 31 2 0 48 49 1 6 42 44 2 0 15 16 1 6 9 10 1 0 31 30 1 0 30 29 1 0 29 28 2 0 28 27 1 0 26 27 1 0 41 42 1 0 43 89 1 0 43 90 1 0 43 91 1 0 3 56 1 6 2 54 1 0 2 55 1 0 1 51 1 0 1 52 1 0 1 53 1 0 4 57 1 0 4 58 1 0 4 59 1 0 9 61 1 0 9 62 1 0 8 60 1 1 10 63 1 6 45 92 1 6 40 88 1 6 23 75 1 0 23 76 1 0 18 71 1 1 49 95 1 0 49 96 1 0 49 97 1 0 16 67 1 0 16 68 1 0 16 69 1 0 39 85 1 0 39 86 1 0 39 87 1 0 25 77 1 0 25 78 1 0 25 79 1 0 47 93 1 0 47 94 1 0 13 64 1 0 13 65 1 0 13 66 1 0 21 72 1 0 21 73 1 0 21 74 1 0 35 84 1 1 26 80 1 6 31 83 1 0 29 82 1 0 28 81 1 0 M END