0 mol 58 unq 0 iso 0 dist 9.81637 11.9429 6.62496 10.5083 9.64665 4.67832 14.7768 9.95364 8.80614 10.4309 numMergedOcc 0
1 mol 61 unq 0 iso 0 dist 5.50504 7.62418 6.65721 5.31827 8.76003 5.83489 16.6215 13.5488 9.25641 14.7343 numMergedOcc 0
2 mol 72 unq 0 iso 0 dist 5.48831 13.0773 9.96708 5.94737 7.321 9.0131 14.4253 11.6378 9.27838 13.1462 numMergedOcc 0
3 mol 85 unq 0 iso 0 dist 9.9795 9.53239 7.97049 5.84688 9.47876 7.98917 5.20528 9.29301 9.82915 10.0297 numMergedOcc 0
4 mol 85 unq 1 iso 0 dist 9.9795 13.0232 6.19965 5.84688 9.47876 11.6116 15.5866 8.09967 7.54568 11.8261 numMergedOcc 0
5 mol 102 unq 0 iso 0 dist 8.84131 8.90571 7.36792 6.87786 9.94856 5.498 14.9418 7.42011 8.31932 13.2332 numMergedOcc 0
6 mol 134 unq 0 iso 0 dist 8.84656 10.879 6.37586 13.386 5.42582 5.41704 7.85849 5.29786 6.23142 8.73604 numMergedOcc 0
7 mol 134 unq 1 iso 0 dist 8.84656 16.7911 9.71307 13.386 5.42582 6.17103 7.85849 5.29786 9.94764 8.73604 numMergedOcc 0
8 mol 134 unq 2 iso 0 dist 4.9155 9.30817 6.54501 13.386 8.6355 10.1448 7.85849 5.71679 7.69991 8.73604 numMergedOcc 0
9 mol 134 unq 3 iso 0 dist 4.9155 10.879 6.49416 13.386 8.6355 5.41704 7.85849 5.71679 6.23142 8.73604 numMergedOcc 0
10 mol 134 unq 4 iso 0 dist 8.49987 6.47843 6.54501 15.6111 8.6355 10.1448 10.2775 5.71679 7.69991 8.73604 numMergedOcc 0
11 mol 134 unq 5 iso 0 dist 8.49987 10.9399 6.49416 15.6111 8.6355 5.41704 10.2775 5.71679 6.23142 8.73604 numMergedOcc 0
12 mol 134 unq 6 iso 0 dist 9.42271 6.16353 6.54501 11.8215 8.6355 10.1448 6.08299 5.71679 7.69991 8.73604 numMergedOcc 0
13 mol 134 unq 7 iso 0 dist 9.42271 7.07625 6.49416 11.8215 8.6355 5.41704 6.08299 5.71679 6.23142 8.73604 numMergedOcc 0
14 mol 220 unq 0 iso 0 dist 8.14644 12.2116 9.23153 8.02272 6.84247 6.7067 11.3009 7.11498 6.59716 9.7334 numMergedOcc 0
15 mol 220 unq 1 iso 0 dist 8.14644 12.2116 9.23153 9.32762 6.99002 15.9568 11.3009 7.11498 6.59716 13.5801 numMergedOcc 0
16 mol 222 unq 0 iso 0 dist 7.88846 6.17038 7.54212 5.66378 7.18956 7.61682 14.1993 13.3447 9.07471 16.4961 numMergedOcc 0
17 mol 235 unq 0 iso 0 dist 6.45574 6.70342 5.4638 5.61388 8.21247 4.65302 4.46919 7.60081 9.55668 7.95766 numMergedOcc 0
18 mol 235 unq 1 iso 0 dist 8.14407 6.01036 5.4638 6.59128 8.21247 4.65302 9.62712 7.60081 9.55668 7.95766 numMergedOcc 0
19 mol 264 unq 0 iso 0 dist 7.37999 11.0659 6.24356 11.9746 9.0012 5.12409 13.4374 7.52936 5.93616 5.91213 numMergedOcc 0
20 mol 264 unq 1 iso 0 dist 7.37999 11.0659 6.24356 11.2015 9.5784 9.67998 13.4374 7.52936 5.93616 7.34094 numMergedOcc 0
21 mol 264 unq 2 iso 0 dist 7.36703 5.91731 6.24356 7.25333 9.0012 5.12409 10.6141 7.52936 5.93616 5.91213 numMergedOcc 0
22 mol 264 unq 3 iso 0 dist 7.36703 5.91731 6.24356 10.3867 9.5784 9.67998 10.6141 7.52936 5.93616 7.34094 numMergedOcc 0
