| [5fa2ba] | 1 | REMARK [C@1H2]-1([C@2H2][C]([CH]=[C@1]-2([C@2H2][C@2H2][C@2H]-3([C@2H]-4([C@2]([C@2H2][C@2H2][C@1H]-3[C@2]-1-2[CH3])([CH3])[C@2H]([O
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| 2 | ATOM 1 C 1 2.521 -1.357 -0.154
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| 3 | ATOM 2 C 1 3.937 -1.470 0.442
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| 4 | ATOM 3 C 1 4.523 -0.111 0.744
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| 5 | ATOM 4 C 1 3.576 0.989 1.033
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| 6 | ATOM 5 C 1 2.242 0.860 1.044
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| 7 | ATOM 6 C 1 1.267 1.895 1.550
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| 8 | ATOM 7 C 1 0.005 1.993 0.673
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| 9 | ATOM 8 C 1 -0.641 0.611 0.464
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| 10 | ATOM 9 C 1 -1.917 0.707 -0.393
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| 11 | ATOM 10 C 1 -2.559 -0.677 -0.603
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| 12 | ATOM 11 C 1 -1.554 -1.679 -1.201
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| 13 | ATOM 12 C 1 -0.278 -1.775 -0.344
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| 14 | ATOM 13 C 1 0.364 -0.391 -0.133
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| 15 | ATOM 14 C 1 1.626 -0.486 0.746
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| 16 | ATOM 15 C 1 1.306 -1.214 2.048
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| 17 | ATOM 16 C 1 -2.876 -1.316 0.745
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| 18 | ATOM 17 C 1 -3.934 -0.384 -1.233
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| 19 | ATOM 18 O 1 -4.863 -1.430 -0.937
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| 20 | ATOM 19 C 1 -4.374 0.941 -0.585
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| 21 | ATOM 20 C 1 -3.103 1.630 -0.055
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| 22 | ATOM 21 O 1 5.739 0.073 0.750
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| 23 | ATOM 22 H 1 -5.045 0.733 0.247
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| 24 | ATOM 23 H 1 -4.841 1.575 -1.336
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| 25 | ATOM 24 H 1 -3.175 1.744 1.025
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| 26 | ATOM 25 H 1 -2.971 2.585 -0.559
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| 27 | ATOM 26 H 1 0.268 2.421 -0.293
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| 28 | ATOM 27 H 1 -0.713 2.661 1.145
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| 29 | ATOM 28 H 1 0.979 1.652 2.571
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| 30 | ATOM 29 H 1 1.757 2.866 1.587
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| 31 | ATOM 30 H 1 -0.523 -2.212 0.622
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| 32 | ATOM 31 H 1 0.436 -2.436 -0.832
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| 33 | ATOM 32 H 1 -1.291 -1.369 -2.210
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| 34 | ATOM 33 H 1 -2.019 -2.660 -1.269
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| 35 | ATOM 34 H 1 3.898 -2.059 1.356
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| 36 | ATOM 35 H 1 4.582 -1.996 -0.258
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| 37 | ATOM 36 H 1 2.580 -0.913 -1.146
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| 38 | ATOM 37 H 1 2.086 -2.350 -0.245
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| 39 | ATOM 38 H 1 3.989 1.963 1.250
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| 40 | ATOM 39 H 1 -3.852 -0.280 -2.313
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| 41 | ATOM 40 H 1 -1.579 1.021 -1.378
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| 42 | ATOM 41 H 1 0.669 -0.012 -1.107
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| 43 | ATOM 42 H 1 -0.936 0.236 1.442
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| 44 | ATOM 43 H 1 0.862 -2.182 1.823
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| 45 | ATOM 44 H 1 0.605 -0.621 2.633
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| 46 | ATOM 45 H 1 2.222 -1.359 2.617
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| 47 | ATOM 46 H 1 -3.329 -2.293 0.586
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| 48 | ATOM 47 H 1 -3.568 -0.681 1.294
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| 49 | ATOM 48 H 1 -1.958 -1.431 1.317
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| 50 | ATOM 49 H 1 -5.209 -1.809 -1.760
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| 51 | TER
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| 52 | CONECT 1 2 14 36 37
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| 53 | CONECT 2 1 3 34 35
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| 54 | CONECT 3 2 4 21 0
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| 55 | CONECT 4 3 5 38 0
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| 56 | CONECT 5 4 6 14 0
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| 57 | CONECT 6 5 7 28 29
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| 58 | CONECT 7 6 8 26 27
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| 59 | CONECT 8 7 9 13 42
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| 60 | CONECT 9 8 10 20 40
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| 61 | CONECT 10 9 11 16 17
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| 62 | CONECT 11 10 12 32 33
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| 63 | CONECT 12 11 13 30 31
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| 64 | CONECT 13 8 12 14 41
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| 65 | CONECT 14 1 5 13 15
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| 66 | CONECT 15 14 43 44 45
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| 67 | CONECT 16 10 46 47 48
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| 68 | CONECT 17 10 18 19 39
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| 69 | CONECT 18 17 49 0 0
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| 70 | CONECT 19 17 20 22 23
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| 71 | CONECT 20 9 19 24 25
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| 72 | CONECT 21 3 0 0 0
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