B45PTN -OEChem-04042101543D 37 39 0 0 0 0 0 0 0999 V2000 2.8599 -1.7627 0.2211 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2968 0.5730 0.0709 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6577 0.4472 0.1429 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0104 0.6715 0.0012 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9196 3.4315 -0.1244 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3939 0.7724 -0.0711 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1298 -1.3270 0.2658 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8331 -1.5402 0.0527 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5701 -2.1508 0.0039 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2064 2.6983 -0.0586 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1714 1.2981 0.0054 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4871 1.2113 0.0748 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4494 3.3209 -0.0526 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6179 2.5789 0.0149 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1341 1.4096 -0.0648 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0899 2.7743 -0.1269 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5628 -2.7033 0.3409 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7835 -0.9523 0.2104 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7771 -0.5809 -0.0187 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5349 -3.3686 -1.0196 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1215 -0.8808 -0.0427 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2818 -2.8103 0.0992 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6261 -3.1102 0.0752 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5148 4.4057 -0.1012 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5826 3.0741 0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5292 0.9717 0.1434 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9110 -3.2416 1.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5794 -2.7064 0.7461 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9758 3.3954 -0.1807 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1766 1.4187 -0.1247 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8394 -0.6013 0.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5222 -3.3848 -1.4354 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1765 -2.8353 -1.7291 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8894 -4.4013 -0.9465 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8916 -0.1200 -0.0999 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5238 -3.5816 0.1566 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9857 -4.1310 0.1126 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 2 0 0 0 0 2 11 1 0 0 0 0 2 12 2 0 0 0 0 3 12 1 0 0 0 0 3 18 1 0 0 0 0 3 26 1 0 0 0 0 4 11 2 0 0 0 0 4 15 1 0 0 0 0 5 10 2 0 0 0 0 5 16 1 0 0 0 0 6 15 1 0 0 0 0 6 19 1 0 0 0 0 6 30 1 0 0 0 0 7 17 1 0 0 0 0 7 18 1 0 0 0 0 7 31 1 0 0 0 0 8 19 2 0 0 0 0 8 22 1 0 0 0 0 9 21 2 0 0 0 0 9 23 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 12 14 1 0 0 0 0 13 14 2 0 0 0 0 13 24 1 0 0 0 0 14 25 1 0 0 0 0 15 16 2 0 0 0 0 16 29 1 0 0 0 0 17 20 1 0 0 0 0 17 27 1 0 0 0 0 17 28 1 0 0 0 0 19 21 1 0 0 0 0 20 32 1 0 0 0 0 20 33 1 0 0 0 0 20 34 1 0 0 0 0 21 35 1 0 0 0 0 22 23 2 0 0 0 0 22 36 1 0 0 0 0 23 37 1 0 0 0 0 M END $$$$