RDKit 3D 48 52 0 0 0 0 0 0 0 0999 V2000 4.8179 -1.4097 -1.0129 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4150 -0.7700 0.2841 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2803 0.4385 0.4975 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9524 -0.4239 0.2921 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5145 0.8041 0.4686 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1149 1.1834 0.4889 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7285 1.5719 1.8098 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8617 2.2910 -0.3260 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3969 2.6597 -0.0436 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2363 1.8013 -0.6940 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.6500 2.2477 -0.8296 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6647 1.2150 -0.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4296 -0.1030 -0.6699 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7635 -0.7405 -0.6743 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5853 0.1496 0.0611 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0379 1.3984 -0.0683 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6143 2.4925 0.1710 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0280 -0.5521 -0.7716 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.8163 -1.8991 -0.1443 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3673 -2.3215 -0.2399 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5456 -1.1771 -0.0118 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2058 0.0677 0.1587 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2202 0.4581 0.0188 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.8088 0.5521 1.3988 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9687 -1.4845 0.0449 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3833 -2.6727 -0.1180 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4444 -0.7044 -1.6289 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9519 -1.7824 -1.6042 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4490 -2.2910 -0.7827 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5883 -1.4584 1.1257 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3555 0.1915 0.3826 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0736 0.9809 1.4413 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0679 1.1555 -0.3339 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3213 1.5639 0.6066 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3452 1.0659 2.4241 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7784 1.5977 -1.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8014 2.6247 -1.8736 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8016 3.1374 -0.1708 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1394 -0.8502 -1.7124 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6720 -1.7199 -0.1489 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6810 -0.5919 -1.8266 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1031 -1.8765 0.9227 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4640 -2.6532 -0.6402 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1685 -3.0717 0.5503 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2226 -2.8207 -1.2175 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1450 0.0561 2.1351 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9892 1.6212 1.6987 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8002 0.0484 1.4539 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 1 0 4 5 2 0 5 6 1 0 6 7 1 1 6 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 2 0 13 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 25 1 0 25 26 2 0 21 22 2 0 22 23 1 0 23 24 1 1 25 4 1 0 22 6 1 0 23 10 1 0 16 12 1 0 23 18 1 0 1 27 1 0 1 28 1 0 1 29 1 0 2 30 1 0 3 31 1 0 3 32 1 0 3 33 1 0 5 34 1 0 7 35 1 0 10 36 1 6 11 37 1 0 11 38 1 0 14 39 1 0 14 40 1 0 18 41 1 6 19 42 1 0 19 43 1 0 20 44 1 0 20 45 1 0 24 46 1 0 24 47 1 0 24 48 1 0 M END