0 mol 13 unq 0 iso 0 dist 7.68531 5.27699 7.44816 10.3134 6.00107 6.791 8.66515 5.58571 7.42612 8.27119 numMergedOcc 0
1 mol 19 unq 0 iso 0 dist 5.9255 5.02625 7.14945 7.97654 5.53102 5.6031 11.1536 5.76052 10.6601 5.72005 numMergedOcc 0
2 mol 19 unq 1 iso 0 dist 5.9255 6.50749 6.50337 7.97654 5.53102 8.7083 11.1536 5.76052 11.0464 5.72005 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 4.82824 8.21111 5.62694 7.34653 8.31317 6.41115 10.041 10.9695 7.37171 4.27766 numMergedOcc 0
4 mol 81 unq 0 iso 0 dist 9.61137 11.8972 7.19581 8.57407 9.08333 7.50394 7.94697 5.89527 11.5303 8.96045 numMergedOcc 0
5 mol 91 unq 0 iso 0 dist 8.45083 9.59807 9.61935 10.1586 5.97918 7.35297 12.3676 4.52107 10.5813 7.71625 numMergedOcc 0
6 mol 107 unq 0 iso 0 dist 7.06322 9.85159 7.02709 4.05182 6.71858 10.1994 4.99934 3.35244 9.45682 5.31375 numMergedOcc 0
7 mol 107 unq 1 iso 0 dist 7.06322 9.85159 7.02709 4.11617 9.37159 12.9752 4.99934 3.35244 9.45682 6.49371 numMergedOcc 0
8 mol 113 unq 0 iso 0 dist 5.6738 11.224 5.82487 7.6316 6.03035 8.01602 6.38269 4.62493 9.4359 8.67025 numMergedOcc 0
9 mol 186 unq 0 iso 0 dist 5.99965 5.48717 9.83935 6.7954 7.54492 11.0961 15.3425 12.998 18.944 9.17458 numMergedOcc 0
10 mol 186 unq 1 iso 0 dist 5.99965 5.48717 9.83935 6.7954 7.54492 11.0961 13.8206 11.8806 18.0284 7.36794 numMergedOcc 0
11 mol 287 unq 0 iso 0 dist 7.64453 16.3901 9.29241 14.1553 9.62446 14.0303 7.96707 3.39991 11.5975 8.06767 numMergedOcc 0
12 mol 287 unq 1 iso 0 dist 7.64453 16.3901 9.29241 4.60276 9.99681 18.685 7.96707 3.39991 11.5975 9.91087 numMergedOcc 0
13 mol 288 unq 0 iso 0 dist 7.64453 16.3901 9.29241 14.1553 9.62446 14.0303 7.96707 3.39991 11.5975 8.06767 numMergedOcc 0
14 mol 288 unq 1 iso 0 dist 7.64453 16.3901 9.29241 4.60276 9.99681 18.685 7.96707 3.39991 11.5975 9.91087 numMergedOcc 0
15 mol 289 unq 0 iso 0 dist 7.64453 16.3901 9.29241 14.1553 9.62446 14.0303 7.96707 3.39991 11.5975 8.06767 numMergedOcc 0
16 mol 289 unq 1 iso 0 dist 7.64453 16.3901 9.29241 4.60276 9.99681 18.685 7.96707 3.39991 11.5975 9.91087 numMergedOcc 0
