ATOM 1 C1A BCH 1 -0.176 2.532 -0.028 -0.0270 0.00 ATOM 2 C2A BCH 1 -0.176 3.864 -0.592 0.1990 0.00 ATOM 3 NA BCH 1 -0.540 1.612 -0.992 -0.0550 0.00 ATOM 4 C3A BCH 1 -0.536 3.724 -1.940 -0.4180 0.00 ATOM 5 C4A BCH 1 -0.756 2.300 -2.164 0.1980 0.00 ATOM 6 CHB BCH 1 -1.156 1.704 -3.376 -0.2730 0.00 ATOM 7 C1B BCH 1 -1.392 0.364 -3.656 -0.0880 0.00 ATOM 8 C2B BCH 1 -1.836 -0.116 -5.032 0.3080 0.00 ATOM 9 NB BCH 1 -1.268 -0.664 -2.776 0.0720 0.00 ATOM 10 C3B BCH 1 -1.856 -1.660 -4.876 0.0680 0.00 ATOM 11 C4B BCH 1 -1.544 -1.860 -3.392 -0.0630 0.00 ATOM 12 CHC BCH 1 -1.536 -3.108 -2.784 -0.2620 0.00 ATOM 13 C1C BCH 1 -1.220 -3.392 -1.440 -0.0500 0.00 ATOM 14 C2C BCH 1 -1.204 -4.688 -0.792 0.2270 0.00 ATOM 15 NC BCH 1 -0.860 -2.388 -0.540 0.0650 0.00 ATOM 16 C3C BCH 1 -0.832 -4.420 0.528 -0.2390 0.00 ATOM 17 C4C BCH 1 -0.632 -3.016 0.628 -0.1310 0.00 ATOM 18 C1E BCH 1 -0.548 -5.028 1.820 0.5420 0.00 ATOM 19 C2E BCH 1 -0.196 -3.800 2.800 -0.2020 0.00 ATOM 20 C3E BCH 1 -0.204 -2.576 1.892 0.0650 0.00 ATOM 21 C1D BCH 1 0.104 -1.260 2.204 -0.1190 0.00 ATOM 22 C2D BCH 1 0.720 -0.760 3.500 0.0910 0.00 ATOM 23 ND BCH 1 -0.072 -0.240 1.308 0.0360 0.00 ATOM 24 C3D BCH 1 0.520 0.772 3.388 0.2620 0.00 ATOM 25 C4D BCH 1 0.196 0.956 1.908 -0.0370 0.00 ATOM 26 CHA BCH 1 0.148 2.204 1.300 -0.2240 0.00 ATOM 28 C5A BCH 1 0.180 5.096 0.172 -0.2380 0.00 ATOM 29 C6A BCH 1 -0.672 4.764 -2.980 0.6950 0.00 ATOM 30 OA BCH 1 -0.748 4.480 -4.184 -0.5370 0.00 ATOM 31 C7A BCH 1 -0.736 6.228 -2.568 -0.3920 0.00 ATOM 32 C5B BCH 1 -3.180 0.484 -5.476 -0.3010 0.00 ATOM 33 C6B BCH 1 -0.860 -2.392 -5.796 0.0640 0.00 ATOM 34 C7B BCH 1 -1.216 -2.288 -7.284 -0.2510 0.00 ATOM 35 C5C BCH 1 -1.520 -6.008 -1.416 -0.3070 0.00 ATOM 36 OE BCH 1 -0.552 -6.200 2.172 -0.5100 0.00 ATOM 37 C5D BCH 1 -0.600 1.300 4.296 -0.2750 0.00 ATOM 38 C6D BCH 1 2.208 -1.180 3.588 -0.0630 0.00 ATOM 39 C7D BCH 1 2.912 -0.760 4.892 -0.2310 0.00 ATOM 40 C8D BCH 1 2.416 -1.396 6.180 0.6610 0.00 ATOM 41 OD2 BCH 1 2.432 -0.852 7.272 -0.5210 0.00 ATOM 42 OD1 BCH 1 1.988 -2.676 5.988 -0.3250 0.00 ATOM 43 C9D BCH 1 1.580 -3.372 7.204 -0.0280 0.00 ATOM 44 C4E BCH 1 -1.268 -3.736 3.876 0.7350 0.00 ATOM 45 OE2 BCH 1 -2.316 -3.112 3.804 -0.5390 0.00 ATOM 46 OE1 BCH 1 -0.932 -4.520 4.940 -0.3600 0.00 ATOM 47 C5E BCH 1 -1.972 -4.616 5.960 0.0150 0.00 ATOM 48 HA BCH 1 0.400 3.044 1.948 0.1150 0.00 ATOM 49 HB BCH 1 -1.272 2.408 -4.200 0.1680 0.00 ATOM 50 HC BCH 1 -1.804 -3.960 -3.416 0.1470 0.00 ATOM 51 H2B1 BCH 1 -1.068 0.180 -5.772 -0.0140 0.00 ATOM 52 H3B1 BCH 1 -2.868 -2.048 -5.092 0.0150 0.00 ATOM 53 H2D1 BCH 1 0.184 -1.168 4.372 0.0080 0.00 ATOM 54 H3D1 BCH 1 1.452 1.312 3.632 -0.0160 0.00 ATOM 55 H5A1 BCH 1 0.972 5.676 -0.324 0.0820 0.00 ATOM 56 H5A2 BCH 1 -0.676 5.776 0.296 0.0800 0.00 ATOM 57 H5A3 BCH 1 0.548 4.852 1.180 0.0820 0.00 ATOM 58 H7A1 BCH 1 -1.456 6.396 -1.752 0.0980 0.00 ATOM 59 H7A2 BCH 1 0.244 6.580 -2.216 0.1060 0.00 ATOM 60 H7A3 BCH 1 -1.024 6.820 -3.448 0.1060 0.00 ATOM 61 H5B1 BCH 1 -3.464 0.108 -6.468 0.0600 0.00 ATOM 62 H5B2 BCH 1 -3.128 1.584 -5.532 0.0850 0.00 ATOM 63 H5B3 BCH 1 -3.980 0.220 -4.768 0.0720 0.00 ATOM 64 H6B1 BCH 1 -0.816 -3.456 -5.504 0.0090 0.00 ATOM 65 H6B2 BCH 1 0.152 -1.988 -5.620 0.0010 0.00 ATOM 66 H7B1 BCH 1 -2.212 -2.712 -7.484 0.0510 0.00 ATOM 67 H7B2 BCH 1 -0.488 -2.836 -7.900 0.0580 0.00 ATOM 68 H7B3 BCH 1 -1.220 -1.244 -7.632 0.0640 0.00 ATOM 69 H5C1 BCH 1 -1.424 -6.816 -0.684 0.1090 0.00 ATOM 70 H5C2 BCH 1 -2.544 -6.032 -1.820 0.0960 0.00 ATOM 71 H5C3 BCH 1 -0.840 -6.228 -2.260 0.0840 0.00 ATOM 72 H5D1 BCH 1 -1.544 0.772 4.100 0.0810 0.00 ATOM 73 H5D2 BCH 1 -0.772 2.376 4.132 0.0740 0.00 ATOM 74 H5D3 BCH 1 -0.340 1.156 5.356 0.0550 0.00 ATOM 75 H6D1 BCH 1 2.288 -2.268 3.468 0.0410 0.00 ATOM 76 H6D2 BCH 1 2.752 -0.732 2.740 0.0350 0.00 ATOM 77 H7D1 BCH 1 3.984 -1.016 4.820 0.0970 0.00 ATOM 78 H7D2 BCH 1 2.872 0.324 5.052 0.0690 0.00 ATOM 79 H9D1 BCH 1 2.432 -3.456 7.896 0.0820 0.00 ATOM 80 H9D2 BCH 1 1.240 -4.356 6.868 0.0870 0.00 ATOM 81 H9D3 BCH 1 0.768 -2.824 7.704 0.0720 0.00 ATOM 82 H2E1 BCH 1 0.768 -4.024 3.276 0.0710 0.00 ATOM 83 H5E1 BCH 1 -2.900 -5.012 5.520 0.0810 0.00 ATOM 84 H5E2 BCH 1 -1.576 -5.308 6.712 0.0680 0.00 ATOM 85 H5E3 BCH 1 -2.172 -3.628 6.400 0.0500 0.00 ATOM 27 MMG BCH 1 -0.696 -0.396 -0.748 0.1340 0.00