REMARK Name = LIG000192 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 N LIG 1 -4.138 -0.091 0.101 0.00 0.00 -0.282 N ATOM 2 C LIG 1 -3.727 1.153 -0.357 0.00 0.00 +0.248 C ATOM 3 O LIG 1 -4.335 2.204 -0.342 0.00 0.00 -0.270 OA ATOM 4 C LIG 1 -2.378 0.977 -0.907 0.00 0.00 +0.042 A ATOM 5 C LIG 1 -2.055 -0.376 -0.842 0.00 0.00 -0.018 A ATOM 6 C LIG 1 -0.829 -0.826 -1.303 0.00 0.00 +0.011 A ATOM 7 C LIG 1 0.073 0.113 -1.837 0.00 0.00 -0.030 A ATOM 8 C LIG 1 -0.278 1.484 -1.885 0.00 0.00 +0.006 A ATOM 9 C LIG 1 -1.517 1.927 -1.421 0.00 0.00 +0.014 A ATOM 10 C LIG 1 -3.197 -1.142 -0.264 0.00 0.00 +0.144 C ENDROOT BRANCH 1 17 ATOM 11 O LIG 1 -9.598 0.050 0.830 0.00 0.00 -0.275 OA ATOM 12 C LIG 1 -8.375 -0.007 0.738 0.00 0.00 +0.219 C ATOM 13 N LIG 1 -7.769 -0.270 -0.465 0.00 0.00 -0.255 N ATOM 14 H LIG 1 -8.387 -0.379 -1.258 0.00 0.00 +0.158 HD ATOM 15 C LIG 1 -6.436 -0.518 -0.704 0.00 0.00 +0.240 C ATOM 16 O LIG 1 -6.066 -0.911 -1.810 0.00 0.00 -0.273 OA ATOM 17 C LIG 1 -5.503 -0.405 0.511 0.00 0.00 +0.163 C ATOM 18 C LIG 1 -6.076 0.569 1.541 0.00 0.00 +0.041 C ATOM 19 C LIG 1 -7.471 0.114 1.942 0.00 0.00 +0.098 C ENDBRANCH 1 17 BRANCH 7 20 ATOM 20 C LIG 1 1.429 -0.329 -2.326 0.00 0.00 +0.139 C BRANCH 20 21 ATOM 21 N LIG 1 2.439 -0.067 -1.327 0.00 0.00 -0.307 N ATOM 22 H LIG 1 2.136 -0.037 -0.363 0.00 0.00 +0.149 HD ATOM 23 C LIG 1 3.769 -0.275 -1.622 0.00 0.00 +0.246 C ATOM 24 O LIG 1 4.163 -0.630 -2.727 0.00 0.00 -0.270 OA BRANCH 23 25 ATOM 25 C LIG 1 4.738 -0.092 -0.517 0.00 0.00 +0.055 A ATOM 26 C LIG 1 5.960 -0.762 -0.550 0.00 0.00 +0.024 A ATOM 27 C LIG 1 6.880 -0.591 0.494 0.00 0.00 +0.001 A ATOM 28 C LIG 1 6.531 0.275 1.554 0.00 0.00 +0.071 A ATOM 29 C LIG 1 7.440 0.442 2.590 0.00 0.00 +0.028 A ATOM 30 C LIG 1 8.672 -0.219 2.601 0.00 0.00 +0.002 A ATOM 31 C LIG 1 9.011 -1.069 1.554 0.00 0.00 +0.001 A ATOM 32 N LIG 1 5.359 0.937 1.585 0.00 0.00 -0.254 NA ATOM 33 C LIG 1 8.118 -1.256 0.501 0.00 0.00 +0.010 A ATOM 34 C LIG 1 4.498 0.753 0.554 0.00 0.00 +0.124 A ENDBRANCH 23 25 ENDBRANCH 20 21 ENDBRANCH 7 20 TORSDOF 4