MLN Converted by convert_cif2sdf.py 2026/01/30 11:05:38 58 58 0 0 0 0 0 0 0 0999 V2000 10.7897 2.8066 -2.2379 O 0 0 0 0 0 9.9353 2.1805 -1.0156 P 0 0 0 0 0 8.6755 2.9197 -0.6688 O 0 0 0 0 0 9.7252 0.6348 -1.4437 O 0 0 0 0 0 11.0179 2.0783 0.1810 O 0 0 0 0 0 8.9145 0.3512 -2.5738 C 0 0 0 0 0 7.5152 0.8929 -2.3113 C 0 0 0 0 0 8.8856 -1.1567 -2.8452 C 0 0 0 0 0 10.2838 -1.7147 -3.1357 C 0 0 0 0 0 10.2868 -3.2167 -3.4295 C 0 0 0 0 0 11.6600 -3.7615 -3.7924 C 0 0 0 0 0 7.0150 0.9130 -1.1886 O 0 0 0 0 0 6.9038 1.3656 -3.4630 N 0 0 0 0 0 5.5812 1.9450 -3.4657 C 0 0 0 0 0 5.3947 2.9587 -4.6031 C 0 0 0 0 0 6.3199 4.1906 -4.5296 C 0 0 0 0 0 6.1052 4.9192 -3.2003 C 0 0 0 0 0 7.7961 3.8193 -4.6810 C 0 0 0 0 0 4.5831 0.7957 -3.6137 C 0 0 0 0 0 3.3973 1.0722 -2.9357 N 0 0 0 0 0 4.8320 -0.1967 -4.2918 O 0 0 0 0 0 2.2457 0.2553 -2.8415 C 0 0 0 0 0 1.1534 0.7055 -2.1182 C 0 0 0 0 0 0.0184 -0.0996 -2.0259 C 0 0 0 0 0 -0.0080 -1.3435 -2.6574 C 0 0 0 0 0 1.1006 -1.7813 -3.3811 C 0 0 0 0 0 2.2357 -0.9762 -3.4734 C 0 0 0 0 0 -1.1637 -2.1623 -2.5627 N 0 3 0 0 0 -2.1504 -1.7501 -1.9063 O 0 5 0 0 0 -1.1673 -3.2780 -3.1379 O 0 0 0 0 0 10.9858 3.7677 -2.2363 H 0 0 0 0 0 11.2503 2.8884 0.6813 H 0 0 0 0 0 9.3408 0.8877 -3.4287 H 0 0 0 0 0 8.4667 -1.6684 -1.9707 H 0 0 0 0 0 8.2224 -1.3760 -3.6909 H 0 0 0 0 0 10.9535 -1.5085 -2.2913 H 0 0 0 0 0 10.7017 -1.1948 -4.0060 H 0 0 0 0 0 9.6038 -3.4071 -4.2667 H 0 0 0 0 0 9.8918 -3.7670 -2.5678 H 0 0 0 0 0 11.5808 -4.8134 -4.0852 H 0 0 0 0 0 12.0932 -3.2077 -4.6318 H 0 0 0 0 0 12.3501 -3.7046 -2.9463 H 0 0 0 0 0 7.4122 1.3437 -4.3415 H 0 0 0 0 0 5.4381 2.4136 -2.4868 H 0 0 0 0 0 5.5620 2.4487 -5.5617 H 0 0 0 0 0 4.3502 3.2959 -4.6221 H 0 0 0 0 0 6.0558 4.8867 -5.3343 H 0 0 0 0 0 5.0605 5.2291 -3.0907 H 0 0 0 0 0 6.3593 4.2777 -2.3485 H 0 0 0 0 0 6.7267 5.8183 -3.1442 H 0 0 0 0 0 8.0955 3.0725 -3.9381 H 0 0 0 0 0 8.4325 4.7012 -4.5485 H 0 0 0 0 0 8.0063 3.4167 -5.6762 H 0 0 0 0 0 3.3370 1.9639 -2.4478 H 0 0 0 0 0 1.1634 1.6726 -1.6225 H 0 0 0 0 0 -0.8394 0.2538 -1.4584 H 0 0 0 0 0 1.0929 -2.7489 -3.8774 H 0 0 0 0 0 3.0940 -1.3284 -4.0412 H 0 0 0 0 0 1 2 1 0 0 0 1 31 1 0 0 0 2 3 2 0 0 0 2 4 1 0 0 0 2 5 1 0 0 0 4 6 1 0 0 0 5 32 1 0 0 0 6 7 1 0 0 0 6 8 1 0 0 0 6 33 1 0 0 0 7 12 2 0 0 0 7 13 1 0 0 0 8 9 1 0 0 0 8 34 1 0 0 0 8 35 1 0 0 0 9 10 1 0 0 0 9 36 1 0 0 0 9 37 1 0 0 0 10 11 1 0 0 0 10 38 1 0 0 0 10 39 1 0 0 0 11 40 1 0 0 0 11 41 1 0 0 0 11 42 1 0 0 0 13 14 1 0 0 0 13 43 1 0 0 0 14 15 1 0 0 0 14 19 1 0 0 0 14 44 1 0 0 0 15 16 1 0 0 0 15 45 1 0 0 0 15 46 1 0 0 0 16 17 1 0 0 0 16 18 1 0 0 0 16 47 1 0 0 0 17 48 1 0 0 0 17 49 1 0 0 0 17 50 1 0 0 0 18 51 1 0 0 0 18 52 1 0 0 0 18 53 1 0 0 0 19 20 1 0 0 0 19 21 2 0 0 0 20 22 1 0 0 0 20 54 1 0 0 0 22 23 2 0 0 0 22 27 1 0 0 0 23 24 1 0 0 0 23 55 1 0 0 0 24 25 2 0 0 0 24 56 1 0 0 0 25 26 1 0 0 0 25 28 1 0 0 0 26 27 2 0 0 0 26 57 1 0 0 0 27 58 1 0 0 0 28 29 1 0 0 0 28 30 2 0 0 0 M END $$$$