B4PH2I -OEChem-04042104273D 40 41 0 0 0 0 0 0 0999 V2000 2.2661 0.6286 0.7397 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1251 -0.7766 -0.8609 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8062 -2.8512 -0.0332 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6674 -1.5403 0.7759 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6094 -1.4691 0.5001 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9690 -0.5289 -0.6683 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9946 1.7190 0.1645 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6812 2.9668 0.9873 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5372 1.9001 -1.2822 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4865 1.3946 0.2275 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4920 -3.1867 -0.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6085 -2.9218 0.3791 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3922 -1.6356 -0.0996 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9977 -0.1684 0.3053 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9573 0.3975 -0.4264 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4204 -0.5815 0.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1350 0.5400 0.6945 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0396 1.7493 -0.8008 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2002 1.8842 0.3134 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1723 2.4802 -0.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9633 2.8212 2.0363 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2057 3.8492 0.6067 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6048 3.1743 0.9823 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8478 2.8811 -1.6613 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4454 1.8416 -1.3591 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9494 1.1712 -1.9844 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0820 2.2983 0.0512 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8264 0.6684 -0.5149 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7600 0.9997 1.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4891 -4.2492 -0.8859 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6496 -2.6214 -1.5453 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4567 -3.5102 1.2905 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5711 -3.2107 -0.0564 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2612 -3.6105 0.4686 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1207 -1.2483 1.5803 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1298 -2.1784 0.9988 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9315 0.0753 1.2644 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2461 2.2215 -1.3711 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0680 2.4758 0.5947 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2515 3.5271 -0.7024 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 1 16 1 0 0 0 0 2 16 2 0 0 0 0 3 11 1 0 0 0 0 3 13 1 0 0 0 0 3 34 1 0 0 0 0 4 12 1 0 0 0 0 4 16 1 0 0 0 0 4 35 1 0 0 0 0 5 13 1 0 0 0 0 5 14 1 0 0 0 0 5 36 1 0 0 0 0 6 13 2 0 0 0 0 6 15 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 8 21 1 0 0 0 0 8 22 1 0 0 0 0 8 23 1 0 0 0 0 9 24 1 0 0 0 0 9 25 1 0 0 0 0 9 26 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 14 15 1 0 0 0 0 14 17 2 0 0 0 0 15 18 2 0 0 0 0 17 19 1 0 0 0 0 17 37 1 0 0 0 0 18 20 1 0 0 0 0 18 38 1 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 40 1 0 0 0 0 M END $$$$