RDKit 3D 99102 0 0 0 0 0 0 0 0999 V2000 1.4096 -1.1236 -2.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9262 -0.7936 -1.2861 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9466 -0.8137 -0.1616 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8768 0.2301 -0.2462 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2393 0.0377 -0.3633 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6645 -1.1391 -0.3988 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1419 1.1952 -0.4417 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4515 1.0356 -0.5549 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4146 2.1111 -0.6381 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7651 1.7638 -0.7593 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7093 2.7415 -0.8368 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3746 4.0587 -0.7996 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 4.3989 -0.6818 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0566 3.4378 -0.5986 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2241 -0.7162 1.1186 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0585 -1.6542 1.1825 C 0 0 2 0 0 0 0 0 0 0 0 0 0.6448 -2.9655 1.2586 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5438 -3.7260 2.4134 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1713 -5.0715 2.4251 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0728 -3.2271 3.3758 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9011 -1.6051 0.0272 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.5782 -2.8268 -0.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3048 -1.7619 0.3581 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.7970 -3.0351 0.5960 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6703 -3.7941 -0.0647 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0426 -5.1456 0.3962 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1607 -3.3244 -1.0825 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9190 -0.7126 1.3226 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.2756 -1.1087 1.4122 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9120 -1.5285 2.5437 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3426 -1.9224 2.5304 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2803 -1.5824 3.6079 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9280 0.6039 0.6231 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2780 1.4743 1.3843 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2406 1.2902 2.8511 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5524 2.6236 0.7393 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.2846 2.7056 1.3854 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1409 3.8073 2.1119 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4758 3.8193 2.7572 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6648 4.7867 2.1907 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2784 2.3866 -0.7224 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1039 1.3996 -1.4394 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.3903 0.0975 -1.8328 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7456 0.4776 -3.0541 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2485 0.1473 -4.3084 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6154 0.5194 -5.5946 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3130 -0.5121 -4.3422 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4560 -0.4524 -0.8674 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.3987 1.1696 -0.6748 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9992 2.5430 -0.4535 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4279 0.3680 -1.3729 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4793 -1.3487 -2.5937 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8426 -1.2314 -3.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4847 -1.7851 -0.1985 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7592 2.2005 -0.4091 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7970 0.0017 -0.5847 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0461 0.7304 -0.7904 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7603 2.4429 -0.9312 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1464 4.8164 -0.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7712 5.4284 -0.6499 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0305 3.7445 -0.5063 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0064 0.3070 1.4709 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9432 -1.1054 1.9114 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4406 -1.4046 2.1542 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8645 -5.6710 1.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2880 -5.0019 2.3784 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8811 -5.6622 3.3198 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1722 -2.7590 -1.8103 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0141 -3.6925 -0.3139 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4989 -2.9230 -1.0362 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8608 -1.5324 -0.5786 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1255 -5.2156 0.6951 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4690 -5.4709 1.2873 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9296 -5.8923 -0.4205 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3571 -0.7432 2.2313 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4304 -2.9646 2.1395 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7597 -1.8468 3.5622 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9305 -1.2616 1.8936 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3461 0.7351 3.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1290 2.3128 3.2733 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1916 0.9104 3.2629 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0365 3.5923 0.9663 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1308 3.1408 2.1554 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9045 4.8209 2.6971 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4665 3.4230 3.7807 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1973 2.1946 -0.9346 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4045 3.4248 -1.1812 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4530 1.8370 -2.3975 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2197 -0.5565 -2.1993 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2602 1.1802 -5.4614 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3836 0.9511 -6.2636 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2841 -0.4272 -6.0762 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2453 0.3698 -0.1131 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4352 3.3552 -0.9368 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2187 2.7189 0.6311 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0302 2.6383 -0.9174 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1416 -0.0692 -2.3498 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9376 -0.3924 -0.7043 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3335 0.9931 -1.6778 H 0 0 0 0 0 0 0 0 0 0 0 0 39 38 1 0 38 40 2 0 38 37 1 0 37 36 1 0 36 41 1 0 41 42 1 0 42 43 1 0 43 44 1 0 44 45 1 0 45 46 1 0 45 47 2 0 43 48 1 0 48 2 1 0 2 1 2 3 2 3 1 0 3 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 18 20 2 0 16 21 1 0 21 22 1 6 21 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 25 27 2 0 23 28 1 0 28 29 1 0 29 30 1 0 30 31 1 0 30 32 2 0 28 33 1 0 33 34 2 0 34 35 1 0 33 49 1 0 49 50 1 0 49 51 1 0 3 4 1 0 4 5 1 0 5 6 2 0 5 7 1 0 7 8 2 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 2 0 12 13 1 0 13 14 2 0 34 36 1 0 14 9 1 0 49 42 1 0 21 48 1 0 39 83 1 0 39 84 1 0 39 85 1 0 36 82 1 6 41 86 1 0 41 87 1 0 42 88 1 6 43 89 1 6 46 90 1 0 46 91 1 0 46 92 1 0 48 93 1 1 1 52 1 0 1 53 1 0 3 54 1 1 15 62 1 0 15 63 1 0 16 64 1 1 19 65 1 0 19 66 1 0 19 67 1 0 22 68 1 0 22 69 1 0 22 70 1 0 23 71 1 6 26 72 1 0 26 73 1 0 26 74 1 0 28 75 1 1 31 76 1 0 31 77 1 0 31 78 1 0 35 79 1 0 35 80 1 0 35 81 1 0 50 94 1 0 50 95 1 0 50 96 1 0 51 97 1 0 51 98 1 0 51 99 1 0 7 55 1 0 8 56 1 0 10 57 1 0 11 58 1 0 12 59 1 0 13 60 1 0 14 61 1 0 M END