RDKit 3D 47 48 0 0 0 0 0 0 0 0999 V2000 -4.3953 -1.2268 -0.3209 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9429 -0.7979 -0.3655 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6317 -0.3721 -1.7682 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5394 0.1718 0.6712 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.7866 -0.4569 1.9274 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0601 0.3997 0.5522 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5443 0.9566 -0.4426 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1960 -0.0123 1.5709 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1966 0.1537 1.5431 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8811 -0.5693 0.4413 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3397 -1.3445 -0.5014 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4708 -1.8455 -1.3923 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2953 -0.6750 -1.2969 N 0 0 2 0 0 4 0 0 0 0 0 0 2.7267 0.4280 -1.7850 O 0 0 0 0 0 1 0 0 0 0 0 0 4.6796 -0.7914 -1.5309 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1888 0.4183 -0.7186 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0932 0.6517 0.3432 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4127 1.8186 0.1109 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3065 -0.5788 0.1815 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.2044 1.4959 0.7064 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.6490 1.4678 1.1462 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0790 2.2325 -0.4755 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6916 -1.6602 0.6537 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1109 -0.4571 -0.6041 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5570 -2.0771 -1.0509 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3685 -1.7594 -0.1194 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8968 -1.1188 -2.1887 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2938 0.6513 -1.8944 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5390 -0.4817 -2.4282 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3984 0.1020 2.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5906 -0.2666 2.4915 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4880 1.2375 1.5615 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2966 -1.6027 -0.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9979 -2.6815 -0.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1049 -2.0366 -2.4139 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0707 -1.6803 -1.0101 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0011 -0.7151 -2.5836 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1565 0.2148 -0.2636 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2103 1.2614 -1.4414 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6174 0.6355 1.3311 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8757 2.5429 0.6359 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8549 -1.4424 0.6064 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6949 2.1716 1.4855 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8520 2.2080 1.9818 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9583 0.4980 1.5792 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3187 1.7276 0.2733 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1469 3.2049 -0.3164 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 1 1 4 20 1 0 20 21 1 0 20 22 1 0 4 6 1 0 6 7 2 0 6 8 1 0 8 9 1 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 1 0 13 14 1 6 13 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 17 19 1 0 19 10 1 0 19 13 1 0 1 23 1 0 1 24 1 0 1 25 1 0 2 26 1 0 3 27 1 0 3 28 1 0 3 29 1 0 5 30 1 0 20 43 1 1 21 44 1 0 21 45 1 0 21 46 1 0 22 47 1 0 9 31 1 0 9 32 1 0 11 33 1 0 12 34 1 0 12 35 1 0 15 36 1 0 15 37 1 0 16 38 1 0 16 39 1 0 17 40 1 1 18 41 1 0 19 42 1 1 M CHG 2 13 1 14 -1 M END