ATOM 1 C22 BWP 2200 0.191 -0.083 5.626 1.00 20.00 C+0 ATOM 2 N1 BWP 2200 -1.096 -0.004 -1.179 1.00 20.00 N+0 ATOM 3 C2 BWP 2200 -1.985 0.121 -2.153 1.00 20.00 C+0 ATOM 4 C6 BWP 2200 0.197 -0.108 -1.447 1.00 20.00 C+0 ATOM 5 C4 BWP 2200 -0.183 0.032 -3.717 1.00 20.00 C+0 ATOM 6 C3 BWP 2200 -1.553 0.144 -3.465 1.00 20.00 C+0 ATOM 7 N5 BWP 2200 0.653 -0.085 -2.691 1.00 20.00 N+0 ATOM 8 C11 BWP 2200 4.401 0.068 -5.722 1.00 20.00 C+0 ATOM 9 C10 BWP 2200 3.552 -0.570 -6.607 1.00 20.00 C+0 ATOM 10 C9 BWP 2200 2.190 -0.577 -6.377 1.00 20.00 C+0 ATOM 11 C8 BWP 2200 1.674 0.056 -5.254 1.00 20.00 C+0 ATOM 12 C12 BWP 2200 3.891 0.700 -4.603 1.00 20.00 C+0 ATOM 13 C17 BWP 2200 -1.021 -1.168 2.458 1.00 20.00 C+0 ATOM 14 C16 BWP 2200 -0.559 -1.043 1.163 1.00 20.00 C+0 ATOM 15 C13 BWP 2200 2.529 0.701 -4.370 1.00 20.00 C+0 ATOM 16 C15 BWP 2200 0.626 -0.365 0.912 1.00 20.00 C+0 ATOM 17 C18 BWP 2200 -0.300 -0.619 3.508 1.00 20.00 C+0 ATOM 18 C19 BWP 2200 0.881 0.061 3.258 1.00 20.00 C+0 ATOM 19 C20 BWP 2200 1.347 0.184 1.963 1.00 20.00 C+0 ATOM 20 O21 BWP 2200 -0.755 -0.743 4.784 1.00 20.00 O+0 ATOM 21 N7 BWP 2200 0.296 0.050 -5.018 1.00 20.00 N+0 ATOM 22 N14 BWP 2200 1.095 -0.237 -0.401 1.00 20.00 N+0 ATOM 23 BR BWP 2200 -2.786 0.322 -4.887 1.00 20.00 BR+0 ATOM 24 C23 BWP 2200 -0.264 -0.186 7.083 1.00 20.00 C+0 ATOM 25 C24 BWP 2200 0.749 0.520 7.986 1.00 20.00 C+0 ATOM 26 N25 BWP 2200 0.312 0.420 9.385 1.00 20.00 N+0 ATOM 27 C26 BWP 2200 1.323 1.115 10.193 1.00 20.00 C+0 ATOM 28 C27 BWP 2200 -0.926 1.202 9.496 1.00 20.00 C+0 ATOM 29 O28 BWP 2200 -0.356 -1.562 7.457 1.00 20.00 O+0 END