0 mol 60 unq 0 iso 0 dist 8.46609 12.4802 6.43294 4.72836 6.65595 10.6819 20.4977 12.5818 8.8058 17.8366 numMergedOcc 0
1 mol 60 unq 1 iso 0 dist 8.46609 12.4802 6.43294 9.1013 9.25011 11.3621 20.4977 12.5818 8.8058 17.4408 numMergedOcc 0
2 mol 60 unq 2 iso 0 dist 8.46609 12.4802 6.43294 11.7276 8.52121 5.51199 20.4977 12.5818 8.8058 12.1949 numMergedOcc 0
3 mol 75 unq 0 iso 0 dist 8.64872 10.4239 7.79912 12.0967 8.56639 5.64643 9.66481 6.77761 7.16583 11.6681 numMergedOcc 0
4 mol 75 unq 1 iso 0 dist 8.64872 10.4239 7.79912 12.0967 8.56639 5.64643 12.9364 5.06305 7.118 8.24814 numMergedOcc 0
5 mol 75 unq 2 iso 0 dist 8.64872 10.4239 7.79912 9.60759 8.59017 10.4899 9.66481 6.77761 7.16583 13.9013 numMergedOcc 0
6 mol 75 unq 3 iso 0 dist 8.64872 10.4239 7.79912 9.60759 8.59017 10.4899 12.9364 5.06305 7.118 11.548 numMergedOcc 0
7 mol 75 unq 4 iso 0 dist 8.64872 12.0967 8.56639 10.4239 7.79912 5.64643 12.9364 5.06305 8.24814 7.118 numMergedOcc 0
8 mol 75 unq 5 iso 0 dist 8.64872 12.0967 8.56639 9.60759 8.59017 7.00674 12.9364 5.06305 8.24814 11.548 numMergedOcc 0
9 mol 95 unq 0 iso 0 dist 8.13273 14.1434 8.03644 6.56354 9.03572 16.6055 12.9058 11.8978 9.40559 18.3849 numMergedOcc 0
10 mol 95 unq 1 iso 0 dist 8.13273 14.1434 8.03644 6.68919 8.83255 13.8105 12.9058 11.8978 9.40559 15.9184 numMergedOcc 0
11 mol 115 unq 0 iso 0 dist 5.22628 6.8104 6.11741 10.0419 9.33865 8.02349 14.4174 9.97256 9.56867 12.7842 numMergedOcc 0
12 mol 127 unq 0 iso 0 dist 8.09965 8.45411 8.14887 11.3174 9.30299 7.30196 14.4763 10.345 6.65963 8.62711 numMergedOcc 0
13 mol 127 unq 1 iso 0 dist 8.09965 11.3174 9.30299 8.45411 8.14887 7.30196 16.8815 11.0785 7.73139 11.1225 numMergedOcc 0
14 mol 127 unq 2 iso 0 dist 8.09965 11.3174 9.30299 8.45411 8.14887 7.30196 13.2676 8.89539 6.66607 12.2522 numMergedOcc 0
15 mol 127 unq 3 iso 0 dist 8.09965 11.3174 9.30299 8.45411 8.14887 7.30196 14.4763 10.345 8.62711 6.65963 numMergedOcc 0
16 mol 175 unq 0 iso 0 dist 7.94593 13.2723 9.0018 8.63795 7.652 7.42466 18.8679 13.7028 6.6776 11.1815 numMergedOcc 0
17 mol 224 unq 0 iso 0 dist 8.47457 5.15333 6.65832 8.1404 6.60589 6.77699 10.349 5.38198 7.25658 10.8312 numMergedOcc 0
18 mol 224 unq 1 iso 0 dist 8.47457 5.15333 6.65832 15.1783 9.16166 11.328 10.349 5.38198 7.25658 11.1589 numMergedOcc 0
19 mol 248 unq 0 iso 0 dist 9.5107 11.8955 7.69895 6.97887 7.21521 5.55137 16.6942 9.48478 6.44967 11.4848 numMergedOcc 0
20 mol 248 unq 1 iso 0 dist 9.5107 11.8955 7.69895 5.78576 8.2965 10.8081 16.6942 9.48478 6.44967 15.9246 numMergedOcc 0
21 mol 259 unq 0 iso 0 dist 5.29682 5.56656 8.13497 5.48552 8.53687 10.582 10.549 10.908 6.96379 14.2826 numMergedOcc 0
22 mol 259 unq 1 iso 0 dist 6.20344 5.56656 7.88519 6.08432 7.84554 4.86771 10.549 12.7595 6.96379 11.7889 numMergedOcc 0
23 mol 259 unq 2 iso 0 dist 6.20344 5.56656 7.88519 10.3156 7.46176 6.96053 10.549 12.7595 6.96379 11.1532 numMergedOcc 0
24 mol 259 unq 3 iso 0 dist 6.20344 5.56656 7.88519 9.55719 9.18903 10.4881 10.549 12.7595 6.96379 17.4423 numMergedOcc 0
25 mol 261 unq 0 iso 0 dist 9.45818 13.2478 8.45658 10.6944 9.14619 7.00201 20.3169 13.3163 8.50313 11.3146 numMergedOcc 0
26 mol 261 unq 1 iso 0 dist 9.45818 13.2478 8.45658 10.6944 9.14619 7.00201 20.6107 13.6041 7.6414 13.063 numMergedOcc 0
