B9NI3B -OEChem-04022101343D 35 38 0 0 0 0 0 0 0999 V2000 0.0182 -1.5160 0.0292 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6133 1.5094 0.0098 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6902 -1.3714 -0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9314 2.3973 -0.0465 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7452 -2.1356 0.0415 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2444 1.1126 -0.0224 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2561 1.4019 -0.0275 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0573 0.6766 -0.0131 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4340 0.4732 -0.0095 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1037 -0.7207 0.0138 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2534 -0.9125 0.0176 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2563 1.4023 -0.0223 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4821 0.7358 -0.0009 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5195 -0.6592 -0.0005 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7354 0.9927 -0.0192 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3316 -1.3890 0.0221 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3582 -1.7686 0.0343 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8379 0.1378 -0.0026 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6491 -1.2424 0.0242 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7716 0.7556 0.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8065 -0.5569 -0.3805 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1688 0.6769 -0.0136 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2950 2.0163 -0.9355 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2955 2.0511 0.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2312 2.4897 -0.0352 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3601 -2.4759 0.0351 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2040 -2.8453 0.0551 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6521 1.3586 0.1353 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7549 0.5951 1.4631 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7181 -1.1119 -0.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7809 -0.3974 -1.4656 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8640 2.7870 -0.0534 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1441 3.0302 -0.0587 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5776 -3.1331 0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6958 -1.7929 0.0353 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 1 11 1 0 0 0 0 2 13 1 0 0 0 0 2 20 1 0 0 0 0 3 14 1 0 0 0 0 3 21 1 0 0 0 0 4 15 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 19 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 6 22 3 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 23 1 0 0 0 0 7 24 1 0 0 0 0 8 10 1 0 0 0 0 8 12 2 0 0 0 0 9 11 2 0 0 0 0 9 15 1 0 0 0 0 10 16 2 0 0 0 0 11 17 1 0 0 0 0 12 13 1 0 0 0 0 12 25 1 0 0 0 0 13 14 2 0 0 0 0 14 16 1 0 0 0 0 15 18 2 0 0 0 0 16 26 1 0 0 0 0 17 19 2 0 0 0 0 17 27 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 0 0 0 0 20 21 1 0 0 0 0 20 28 1 0 0 0 0 20 29 1 0 0 0 0 21 30 1 0 0 0 0 21 31 1 0 0 0 0 M END $$$$