RDKit 3D 68 70 0 0 0 0 0 0 0 0999 V2000 -9.1016 0.9713 1.5471 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7712 2.3598 1.7179 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.6286 2.7946 1.0713 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8474 1.9198 0.3278 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6958 2.3786 -0.3225 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8650 1.4672 -1.0801 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3056 0.3773 -0.6513 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5282 -0.3444 -1.5945 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2310 -0.6660 -1.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5249 -0.3188 -0.1924 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2111 -0.6825 0.0237 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4207 -1.4346 -0.9419 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7862 -1.8588 -0.7741 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3394 -2.5542 0.1687 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7298 -2.8498 0.1328 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5977 -1.8009 0.3839 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1077 -0.5435 0.6458 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0443 0.4652 0.8899 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3993 0.2557 0.8802 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3731 1.3030 1.1329 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0235 2.5456 1.3759 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0283 3.5698 1.6243 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6926 4.7550 1.8511 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3780 3.2718 1.6176 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8281 -1.0479 0.6087 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9486 -2.0578 0.3636 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3901 -3.3294 0.0980 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7071 -3.7757 0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6382 -3.0919 1.3052 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4077 -2.9325 1.4494 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3169 -3.8080 2.2695 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2827 -1.7994 -2.0955 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5878 -1.4359 -2.3059 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2852 -1.7915 -3.4396 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6070 -2.5611 -4.4191 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3969 -0.1638 0.6773 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9914 0.3809 1.6429 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7923 -1.3884 0.9800 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3643 3.7131 -0.2042 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1297 4.6078 0.5338 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2691 4.1135 1.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0446 4.9821 1.9077 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.1762 0.7471 0.4532 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3505 0.3083 1.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1192 0.8483 1.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1490 0.8942 0.2384 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7002 1.7511 -2.1433 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9811 0.3117 0.5733 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3185 -0.3608 0.9331 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4661 -1.5342 -1.5919 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0593 -0.3344 0.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6543 1.4438 1.0913 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4299 1.0491 1.1194 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9895 2.8444 1.3998 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9205 3.5454 0.8308 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8951 -1.2014 0.6041 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1314 -3.7639 1.0612 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7241 -4.8100 -0.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3216 -3.1172 -0.6297 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3766 -4.8272 2.1396 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2215 -2.3972 -2.8642 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7277 -2.0173 -4.8426 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2801 -2.7132 -5.3092 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2937 -3.5538 -4.0609 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2557 -1.4077 1.8497 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4552 4.0297 -0.7345 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8491 5.6437 0.6086 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8670 4.6262 2.3646 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 1 0 6 7 2 0 7 8 1 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 14 15 1 0 15 16 1 0 16 17 2 0 17 18 1 0 18 19 2 0 19 20 1 0 20 21 2 0 21 22 1 0 22 24 1 0 22 23 2 0 19 25 1 0 25 26 2 0 26 27 1 0 27 28 1 0 14 29 1 0 29 31 1 0 29 30 2 0 12 32 1 0 32 33 2 0 33 34 1 0 34 35 1 0 7 36 1 0 36 38 1 0 36 37 2 0 5 39 2 0 39 40 1 0 40 41 2 0 41 42 1 0 41 3 1 0 33 9 1 0 26 16 1 0 1 43 1 0 1 44 1 0 1 45 1 0 4 46 1 0 6 47 1 0 10 48 1 0 11 49 1 0 13 50 1 0 17 51 1 0 18 52 1 0 20 53 1 0 21 54 1 0 24 55 1 0 25 56 1 0 28 57 1 0 28 58 1 0 28 59 1 0 31 60 1 0 32 61 1 0 35 62 1 0 35 63 1 0 35 64 1 0 38 65 1 0 39 66 1 0 40 67 1 0 42 68 1 0 M END