CI2 Converted by convert_cif2sdf.py 2024/03/29 11:09:15 55 58 0 0 0 0 0 0 0 0999 V2000 5.0487 1.7010 -0.0512 C 0 0 0 0 0 4.4877 0.3230 0.1866 C 0 0 0 0 0 4.9390 -0.3683 1.0676 O 0 0 0 0 0 3.3654 -0.1936 -0.6768 C 0 0 0 0 0 3.3920 -1.7414 -0.7235 C 0 0 0 0 0 2.0066 -2.2184 -0.2084 C 0 0 0 0 0 1.1023 -1.0124 -0.4868 C 0 0 0 0 0 -0.1666 -0.9319 0.3407 C 0 0 0 0 0 -1.0754 -2.1239 0.0438 C 0 0 0 0 0 -2.3685 -1.9954 0.8520 C 0 0 0 0 0 -3.0854 -0.7008 0.4588 C 0 0 0 0 0 -3.3912 -0.7385 -1.0432 C 0 0 0 0 0 -3.9522 0.6039 -1.4566 C 0 0 0 0 0 -4.9888 0.6795 -2.0718 O 0 0 0 0 0 -3.1804 1.8493 -1.0802 C 0 0 0 0 0 -2.8841 1.7992 0.4225 C 0 0 0 0 0 -2.1794 0.4909 0.7756 C 0 0 0 0 0 -1.8217 0.4955 2.2636 C 0 0 0 0 0 -0.8779 0.3764 -0.0401 C 0 0 0 0 0 0.0028 1.5978 0.2045 C 0 0 0 0 0 1.3554 1.4670 -0.5169 C 0 0 0 0 0 2.0177 0.1713 -0.0638 C 0 0 0 0 0 2.1184 0.1493 1.4634 C 0 0 0 0 0 5.8466 1.8973 0.6646 H 0 0 0 0 0 5.4455 1.7630 -1.0647 H 0 0 0 0 0 4.2578 2.4411 0.0746 H 0 0 0 0 0 3.4451 0.2164 -1.6834 H 0 0 0 0 0 3.5488 -2.0827 -1.7466 H 0 0 0 0 0 4.1828 -2.1211 -0.0766 H 0 0 0 0 0 1.6672 -3.0909 -0.7670 H 0 0 0 0 0 2.0447 -2.4341 0.8589 H 0 0 0 0 0 0.8673 -0.9500 -1.5492 H 0 0 0 0 0 0.0865 -0.9171 1.4010 H 0 0 0 0 0 -1.3124 -2.1439 -1.0198 H 0 0 0 0 0 -0.5651 -3.0476 0.3192 H 0 0 0 0 0 -3.0150 -2.8473 0.6425 H 0 0 0 0 0 -2.1313 -1.9714 1.9153 H 0 0 0 0 0 -4.0159 -0.6118 1.0197 H 0 0 0 0 0 -2.4746 -0.9378 -1.5988 H 0 0 0 0 0 -4.1230 -1.5190 -1.2488 H 0 0 0 0 0 -2.2443 1.8829 -1.6371 H 0 0 0 0 0 -3.7765 2.7327 -1.3059 H 0 0 0 0 0 -2.2466 2.6396 0.6947 H 0 0 0 0 0 -3.8196 1.8589 0.9785 H 0 0 0 0 0 -2.7325 0.5908 2.8548 H 0 0 0 0 0 -1.3191 -0.4375 2.5190 H 0 0 0 0 0 -1.1609 1.3357 2.4752 H 0 0 0 0 0 -1.1276 0.3283 -1.1004 H 0 0 0 0 0 -0.5115 2.4864 -0.1599 H 0 0 0 0 0 0.1789 1.7012 1.2749 H 0 0 0 0 0 1.1961 1.4074 -1.5938 H 0 0 0 0 0 1.9849 2.3250 -0.2812 H 0 0 0 0 0 1.1331 0.3223 1.8947 H 0 0 0 0 0 2.4923 -0.8220 1.7889 H 0 0 0 0 0 2.8031 0.9304 1.7930 H 0 0 0 0 0 1 2 1 0 0 0 1 24 1 0 0 0 1 25 1 0 0 0 1 26 1 0 0 0 2 3 2 0 0 0 2 4 1 0 0 0 4 5 1 0 0 0 4 22 1 0 0 0 4 27 1 0 0 0 5 6 1 0 0 0 5 28 1 0 0 0 5 29 1 0 0 0 6 7 1 0 0 0 6 30 1 0 0 0 6 31 1 0 0 0 7 8 1 0 0 0 7 22 1 0 0 0 7 32 1 0 0 0 8 9 1 0 0 0 8 19 1 0 0 0 8 33 1 0 0 0 9 10 1 0 0 0 9 34 1 0 0 0 9 35 1 0 0 0 10 11 1 0 0 0 10 36 1 0 0 0 10 37 1 0 0 0 11 12 1 0 0 0 11 17 1 0 0 0 11 38 1 0 0 0 12 13 1 0 0 0 12 39 1 0 0 0 12 40 1 0 0 0 13 14 2 0 0 0 13 15 1 0 0 0 15 16 1 0 0 0 15 41 1 0 0 0 15 42 1 0 0 0 16 17 1 0 0 0 16 43 1 0 0 0 16 44 1 0 0 0 17 18 1 0 0 0 17 19 1 0 0 0 18 45 1 0 0 0 18 46 1 0 0 0 18 47 1 0 0 0 19 20 1 0 0 0 19 48 1 0 0 0 20 21 1 0 0 0 20 49 1 0 0 0 20 50 1 0 0 0 21 22 1 0 0 0 21 51 1 0 0 0 21 52 1 0 0 0 22 23 1 0 0 0 23 53 1 0 0 0 23 54 1 0 0 0 23 55 1 0 0 0 M END $$$$