B7JN3I -OEChem-04022115403D 29 31 0 0 0 0 0 0 0999 V2000 0.6584 0.7044 0.0309 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8665 -1.3876 -0.0570 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0759 -2.5130 -0.3812 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9701 -0.8134 1.6016 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5573 1.2675 -0.1037 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0642 -0.3387 0.6444 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7644 -0.2445 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0129 0.9212 0.1385 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5108 -0.6606 -0.1847 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8285 -1.3402 -0.2162 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1411 -0.2518 0.0765 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6594 -1.2805 -0.3433 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9283 -0.6095 -0.3104 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6188 2.1397 0.3582 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7684 0.9763 0.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0151 2.1601 0.4383 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8473 -0.9620 0.6083 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2884 0.4550 -1.2422 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4724 1.0837 -1.1969 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4736 0.6938 -0.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6870 -2.3593 -0.4774 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0417 3.0507 0.4656 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8524 1.0291 0.3668 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5295 3.1020 0.6107 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6837 -1.7471 1.3391 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5630 0.7380 -1.9993 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7297 1.8733 -1.8924 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2633 -2.1356 -0.2046 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5850 -1.3118 1.0363 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 1 9 1 0 0 0 0 2 11 1 0 0 0 0 2 28 1 0 0 0 0 3 10 2 0 0 0 0 4 6 1 0 0 0 0 4 29 1 0 0 0 0 5 20 2 0 0 0 0 6 17 1 0 0 0 0 6 20 1 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 14 2 0 0 0 0 9 10 1 0 0 0 0 9 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 21 1 0 0 0 0 13 17 2 0 0 0 0 13 18 1 0 0 0 0 14 16 1 0 0 0 0 14 22 1 0 0 0 0 15 16 2 0 0 0 0 15 23 1 0 0 0 0 16 24 1 0 0 0 0 17 25 1 0 0 0 0 18 19 2 0 0 0 0 18 26 1 0 0 0 0 19 20 1 0 0 0 0 19 27 1 0 0 0 0 M END $$$$