Comment line 1200 atoms 2 atom types 0.0000000E+00 25.1583200000000 xlo xhi 0.0000000E+00 25.1583200000000 ylo yhi 0.0000000E+00 28.0202560000000 zlo zhi Masses 1 28.0855 2 15.9999 Atoms 1 1 2.96653 1.50970 1.50970 0.00000 2 1 2.96653 -1.50970 -1.50970 3.50253 3 1 2.96653 1.00613 4.02553 1.75127 4 1 2.96653 4.02553 1.00613 5.25380 5 2 -1.483265 1.20639 0.51947 1.24998 6 2 -1.483265 -1.20639 -0.51947 4.75252 7 2 -1.483265 1.99636 3.72222 3.00125 8 2 -1.483265 3.03530 1.30944 6.50378 9 2 -1.483265 0.51947 1.20639 -1.24998 10 2 -1.483265 -0.51947 -1.20639 2.25255 11 2 -1.483265 1.30944 3.03530 0.50128 12 2 -1.483265 3.72222 1.99636 4.00381 13 1 2.96653 1.50970 1.50970 7.00506 14 1 2.96653 -1.50970 -1.50970 10.50760 15 1 2.96653 1.00613 4.02553 8.75633 16 1 2.96653 4.02553 1.00613 12.25886 17 2 -1.483265 1.20639 0.51947 8.25505 18 2 -1.483265 -1.20639 -0.51947 11.75758 19 2 -1.483265 1.99636 3.72222 10.00631 20 2 -1.483265 3.03530 1.30944 13.50885 21 2 -1.483265 0.51947 1.20639 5.75508 22 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11.00888 73 1 2.96653 1.50970 6.54136 14.01013 74 1 2.96653 -1.50970 3.52196 17.51266 75 1 2.96653 1.00613 9.05720 15.76139 76 1 2.96653 4.02553 6.03780 19.26393 77 2 -1.483265 1.20639 5.55113 15.26011 78 2 -1.483265 -1.20639 4.51220 18.76264 79 2 -1.483265 1.99636 8.75389 17.01138 80 2 -1.483265 3.03530 6.34110 20.51391 81 2 -1.483265 0.51947 6.23806 12.76014 82 2 -1.483265 -0.51947 3.82527 16.26268 83 2 -1.483265 1.30944 8.06696 14.51141 84 2 -1.483265 3.72222 7.02803 18.01394 85 1 2.96653 1.50970 6.54136 21.01519 86 1 2.96653 -1.50970 3.52196 24.51772 87 1 2.96653 1.00613 9.05720 22.76646 88 1 2.96653 4.02553 6.03780 26.26899 89 2 -1.483265 1.20639 5.55113 22.26518 90 2 -1.483265 -1.20639 4.51220 25.76771 91 2 -1.483265 1.99636 8.75389 24.01644 92 2 -1.483265 3.03530 6.34110 27.51897 93 2 -1.483265 0.51947 6.23806 19.76521 94 2 -1.483265 -0.51947 3.82527 23.26774 95 2 -1.483265 1.30944 8.06696 21.51647 96 2 -1.483265 3.72222 7.02803 25.01901 97 1 2.96653 1.50970 11.57303 0.00000 98 1 2.96653 -1.50970 8.55363 3.50253 99 1 2.96653 1.00613 14.08886 1.75127 100 1 2.96653 4.02553 11.06946 5.25380 101 2 -1.483265 1.20639 10.58280 1.24998 102 2 -1.483265 -1.20639 9.54386 4.75252 103 2 -1.483265 1.99636 13.78555 3.00125 104 2 -1.483265 3.03530 11.37277 6.50378 105 2 -1.483265 0.51947 11.26972 -1.24998 106 2 -1.483265 -0.51947 8.85694 2.25255 107 2 -1.483265 1.30944 13.09863 0.50128 108 2 -1.483265 3.72222 12.05969 4.00381 109 1 2.96653 1.50970 11.57303 7.00506 110 1 2.96653 -1.50970 8.55363 10.50760 111 1 2.96653 1.00613 14.08886 8.75633 112 1 2.96653 4.02553 11.06946 12.25886 113 2 -1.483265 1.20639 10.58280 8.25505 114 2 -1.483265 -1.20639 9.54386 11.75758 115 2 -1.483265 1.99636 13.78555 10.00631 116 2 -1.483265 3.03530 11.37277 13.50885 117 2 -1.483265 0.51947 11.26972 5.75508 118 2 -1.483265 -0.51947 8.85694 9.25761 119 2 -1.483265 1.30944 13.09863 7.50635 120 2 -1.483265 3.72222 12.05969 11.00888 121 1 2.96653 1.50970 11.57303 14.01013 122 1 2.96653 -1.50970 8.55363 17.51266 123 1 2.96653 1.00613 14.08886 15.76139 124 1 2.96653 4.02553 11.06946 19.26393 125 2 -1.483265 1.20639 10.58280 15.26011 126 2 -1.483265 -1.20639 9.54386 18.76264 127 2 -1.483265 1.99636 13.78555 17.01138 128 2 -1.483265 3.03530 11.37277 20.51391 129 2 -1.483265 0.51947 11.26972 12.76014 130 2 -1.483265 -0.51947 8.85694 16.26268 131 2 -1.483265 1.30944 13.09863 14.51141 132 2 -1.483265 3.72222 12.05969 18.01394 133 1 2.96653 1.50970 11.57303 21.01519 134 1 2.96653 -1.50970 8.55363 24.51772 135 1 2.96653 1.00613 14.08886 22.76646 136 1 2.96653 4.02553 11.06946 26.26899 137 2 -1.483265 1.20639 10.58280 22.26518 138 2 -1.483265 -1.20639 9.54386 25.76771 139 2 -1.483265 1.99636 13.78555 24.01644 140 2 -1.483265 3.03530 11.37277 27.51897 141 2 -1.483265 0.51947 11.26972 19.76521 142 2 -1.483265 -0.51947 8.85694 23.26774 143 2 -1.483265 1.30944 13.09863 21.51647 144 2 -1.483265 3.72222 12.05969 25.01901 145 1 2.96653 1.50970 16.60469 0.00000 146 1 2.96653 -1.50970 13.58529 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