D05KSC -OEChem-10191521362D 40 43 0 0 0 0 0 0 0999 V2000 8.4367 1.7114 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.3143 2.3104 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9094 0.5872 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.3017 -1.5596 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2518 -0.6122 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.9641 0.5872 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9367 0.1726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9367 0.1726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6277 1.1236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6217 -0.6122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2457 1.1236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6123 1.3559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9320 0.7989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2312 -0.4035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6422 -0.4035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2611 1.3559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9622 -2.3104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3212 -1.7562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6267 1.7511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2600 0.0583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9773 1.2222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6493 1.9628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2827 0.2700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.4339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8182 -0.8658 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0553 -0.8658 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4459 1.9477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1993 -1.1483 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7133 -1.8781 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4431 -2.3641 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4967 -2.7199 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3717 -2.7760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4277 -1.9009 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0433 2.2102 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4493 -0.5321 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4600 2.5532 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.1892 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1312 2.0398 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3940 1.5651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8688 0.8279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 11 1 0 0 0 0 2 12 2 0 0 0 0 3 12 1 0 0 0 0 3 13 1 0 0 0 0 3 14 1 0 0 0 0 4 10 1 0 0 0 0 4 17 1 0 0 0 0 4 18 1 0 0 0 0 5 8 1 0 0 0 0 5 14 2 0 0 0 0 6 15 1 0 0 0 0 6 16 2 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 7 11 2 0 0 0 0 8 9 2 0 0 0 0 9 12 1 0 0 0 0 10 15 2 0 0 0 0 11 16 1 0 0 0 0 13 19 2 0 0 0 0 13 20 1 0 0 0 0 14 25 1 0 0 0 0 15 26 1 0 0 0 0 16 27 1 0 0 0 0 17 31 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 18 28 1 0 0 0 0 18 29 1 0 0 0 0 18 30 1 0 0 0 0 19 22 1 0 0 0 0 19 34 1 0 0 0 0 20 23 2 0 0 0 0 20 35 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 22 36 1 0 0 0 0 23 37 1 0 0 0 0 24 38 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 M END $$$$