# Created by: Discovery Studio # Creation time: Wed Dec 23 18:25:55 India Standard Time 2009 @MOLECULE 3965284 43 45 1 0 0 SMALL USER_CHARGES @ATOM 1 C1 -0.0158 1.3119 0.0093 C.2 1 <0> 0.0000 2 N1 1.0888 2.0360 0.0026 N.2 1 <0> 0.0000 3 C2 2.2875 1.4625 -0.0119 C.2 1 <0> 0.0000 4 C3 2.3582 0.0588 -0.0202 C.2 1 <0> 0.0000 5 C4 1.1547 -0.6659 -0.0126 C.2 1 <0> 0.0000 6 N2 0.0021 -0.0041 0.0020 N.2 1 <0> 0.0000 7 N3 1.5110 -1.9908 -0.0227 N.pl3 1 <0> 0.0000 8 C5 2.8729 -2.0476 -0.0358 C.2 1 <0> 0.0000 9 N4 3.3680 -0.8441 -0.0343 N.2 1 <0> 0.0000 10 C6 0.5956 -3.1347 -0.0195 C.3 1 <0> 0.0000 11 C7 0.2026 -3.5130 -1.4698 C.3 1 <0> 0.0000 12 C8 -0.1697 -5.0104 -1.2932 C.3 1 <0> 0.0000 13 C9 0.8185 -5.4668 -0.1985 C.3 1 <0> 0.0000 14 O1 1.2535 -4.2982 0.5065 O.3 1 <0> 0.0000 15 C10 0.1174 -6.4245 0.7671 C.3 1 <0> 0.0000 16 O2 1.0664 -6.9325 1.7070 O.3 1 <0> 0.0000 17 P1 0.2644 -7.9275 2.6863 P.3 1 <0> 0.0000 18 O3 -0.8840 -7.2110 3.2849 O.2 1 <0> 0.0000 19 O4 -0.2709 -9.1919 1.8456 O.2 1 <0> 0.0000 20 O5 1.2471 -8.4374 3.8552 O.3 1 <0> 0.0000 21 P2 0.3151 -9.0839 4.9977 P.3 1 <0> 0.0000 22 O6 -0.9014 -8.2582 5.1676 O.2 1 <0> 0.0000 23 O7 -0.1056 -10.5768 4.5661 O.2 1 <0> 0.0000 24 O8 1.1269 -9.1355 6.3871 O.3 1 <0> 0.0000 25 P3 0.0450 -9.4048 7.5486 P.3 1 <0> 0.0000 26 O9 -0.8815 -10.4767 7.1208 O.2 1 <0> 0.0000 27 O10 0.8039 -9.8569 8.8946 O.2 1 <0> 0.0000 28 O11 -0.7879 -8.0559 7.8294 O.2 1 <0> 0.0000 29 O12 -1.5207 -5.1495 -0.8488 O.3 1 <0> 0.0000 30 O13 -0.9222 -2.7515 -1.9138 O.3 1 <0> 0.0000 31 N5 3.4393 2.2295 -0.0193 N.pl3 1 <0> 0.0000 32 H1 -0.9693 1.8187 0.0257 H 1 <0> 0.0000 33 H2 3.4551 -2.9572 -0.0459 H 1 <0> 0.0000 34 H3 -0.2937 -2.9051 0.5675 H 1 <0> 0.0000 35 H4 1.0470 -3.3955 -2.1490 H 1 <0> 0.0000 36 H5 -0.0057 -5.5626 -2.2185 H 1 <0> 0.0000 37 H6 1.6745 -5.9625 -0.6564 H 1 <0> 0.0000 38 H7 -0.6711 -5.8918 1.2986 H 1 <0> 0.0000 39 H8 -0.3173 -7.2520 0.2064 H 1 <0> 0.0000 40 H9 -2.0820 -4.7654 -1.5362 H 1 <0> 0.0000 41 H10 -1.1124 -3.0355 -2.8184 H 1 <0> 0.0000 42 H11 3.3774 3.1975 -0.0138 H 1 <0> 0.0000 43 H12 4.3085 1.7992 -0.0299 H 1 <0> 0.0000 @BOND 1 1 6 2 2 1 2 1 3 1 32 1 4 2 3 2 5 3 4 1 6 3 31 1 7 4 9 1 8 4 5 2 9 5 6 1 10 5 7 1 11 7 8 1 12 7 10 1 13 8 9 2 14 8 33 1 15 10 14 1 16 10 11 1 17 10 34 1 18 11 12 1 19 11 30 1 20 11 35 1 21 12 13 1 22 12 29 1 23 12 36 1 24 13 14 1 25 13 15 1 26 13 37 1 27 15 16 1 28 15 38 1 29 15 39 1 30 16 17 1 31 17 18 2 32 17 19 1 33 17 20 1 34 20 21 1 35 21 22 2 36 21 23 1 37 21 24 1 38 24 25 1 39 25 26 2 40 25 27 1 41 25 28 1 42 29 40 1 43 30 41 1 44 31 42 1 45 31 43 1