0 mol 7 unq 0 iso 0 dist 8.41173 6.22892 6.3027 12.9957 9.58865 10.1204 5.13744 10.2446 6.36911 10.4371 numMergedOcc 0
1 mol 19 unq 0 iso 0 dist 9.79426 7.84393 9.84922 9.27965 9.55978 13.7212 6.31174 9.04865 8.73972 5.72837 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 5.39171 4.24428 8.04817 6.13631 7.84699 6.10011 5.14919 6.4154 5.64598 10.0721 numMergedOcc 0
3 mol 73 unq 1 iso 0 dist 5.39171 4.24428 8.04817 12.6081 7.53504 15.5212 5.14919 6.4154 5.64598 13.2987 numMergedOcc 0
4 mol 73 unq 2 iso 0 dist 5.39171 6.30194 5.2774 6.13631 7.84699 8.124 5.14919 6.4154 4.65521 10.0721 numMergedOcc 0
5 mol 73 unq 3 iso 0 dist 5.39171 6.30194 5.2774 12.6081 7.53504 11.801 5.14919 6.4154 4.65521 13.2987 numMergedOcc 0
6 mol 73 unq 4 iso 0 dist 9.27355 4.24428 9.76331 6.13631 8.40844 6.10011 5.14919 9.51458 5.64598 10.0721 numMergedOcc 0
7 mol 73 unq 5 iso 0 dist 9.27355 4.24428 9.76331 16.1129 7.02351 15.7658 5.14919 9.51458 5.64598 15.2122 numMergedOcc 0
8 mol 73 unq 6 iso 0 dist 9.27355 4.24428 9.76331 12.6081 8.66342 15.5212 5.14919 9.51458 5.64598 13.2987 numMergedOcc 0
9 mol 73 unq 7 iso 0 dist 9.27355 6.30194 5.44275 6.13631 8.40844 8.124 5.14919 9.51458 4.65521 10.0721 numMergedOcc 0
10 mol 73 unq 8 iso 0 dist 9.27355 6.30194 5.44275 16.1129 7.02351 10.9082 5.14919 9.51458 4.65521 15.2122 numMergedOcc 0
11 mol 73 unq 9 iso 0 dist 9.27355 6.30194 5.44275 12.6081 8.66342 11.801 5.14919 9.51458 4.65521 13.2987 numMergedOcc 0
12 mol 73 unq 10 iso 0 dist 8.60363 4.24428 10.4402 6.13631 6.99156 6.10011 5.14919 10.9127 5.64598 10.0721 numMergedOcc 0
13 mol 73 unq 11 iso 0 dist 8.60363 4.24428 10.4402 12.6081 7.21285 15.5212 5.14919 10.9127 5.64598 13.2987 numMergedOcc 0
14 mol 73 unq 12 iso 0 dist 8.60363 6.30194 8.0624 6.13631 6.99156 8.124 5.14919 10.9127 4.65521 10.0721 numMergedOcc 0
15 mol 73 unq 13 iso 0 dist 8.60363 6.30194 8.0624 12.6081 7.21285 11.801 5.14919 10.9127 4.65521 13.2987 numMergedOcc 0
16 mol 214 unq 0 iso 0 dist 9.81136 8.47248 4.82712 14.9808 5.69733 10.1886 15.9026 6.35728 8.60247 5.24956 numMergedOcc 0
17 mol 219 unq 0 iso 0 dist 4.67452 8.09769 10.0509 7.61939 7.98941 14.4403 7.42613 10.719 4.87541 14.6838 numMergedOcc 0
18 mol 220 unq 0 iso 0 dist 7.86207 8.9077 4.90657 11.9931 8.58709 6.21273 10.4277 10.4686 6.84247 5.33649 numMergedOcc 0
19 mol 220 unq 1 iso 0 dist 7.86207 8.9077 4.90657 11.9931 8.58709 6.21273 12.6281 10.0817 6.99002 12.5011 numMergedOcc 0
20 mol 224 unq 0 iso 0 dist 6.6537 7.04127 6.46679 9.80029 7.46044 10.6043 9.20195 9.04427 8.19953 5.56344 numMergedOcc 0
21 mol 258 unq 0 iso 0 dist 6.08181 9.67877 5.09738 11.1086 9.26487 11.1385 13.6436 10.1492 6.49982 10.443 numMergedOcc 0
22 mol 258 unq 1 iso 0 dist 7.70189 9.67877 10.4667 5.79358 6.59521 12.6095 13.6436 15.2899 6.49982 15.5298 numMergedOcc 0
23 mol 265 unq 0 iso 0 dist 4.03921 7.54805 5.11366 5.46523 5.10595 5.3051 8.3872 9.01586 6.34034 6.10503 numMergedOcc 0
24 mol 282 unq 0 iso 0 dist 7.93511 9.51581 5.04235 8.96033 6.40686 9.83042 10.8603 10.0733 7.32347 10.4249 numMergedOcc 0
