0 mol 59 unq 0 iso 0 dist 5.8166 11.9828 8.61357 16.4342 12.9966 8.69443 numMergedOcc 0
1 mol 62 unq 0 iso 0 dist 7.30392 3.91116 6.35789 10.8045 10.1544 9.3913 numMergedOcc 0
2 mol 86 unq 0 iso 0 dist 9.59708 4.4104 8.32885 9.93274 6.24673 7.91639 numMergedOcc 0
3 mol 119 unq 0 iso 0 dist 8.54701 7.72465 9.00829 8.91758 6.16644 5.28955 numMergedOcc 0
4 mol 119 unq 1 iso 0 dist 5.68879 4.85533 9.34752 12.2227 12.8972 9.2167 numMergedOcc 0
5 mol 119 unq 2 iso 0 dist 5.68879 4.85533 9.34752 6.61966 5.7998 6.67306 numMergedOcc 0
6 mol 123 unq 0 iso 0 dist 7.76707 7.02849 8.56386 14.499 10.9839 9.28454 numMergedOcc 0
7 mol 123 unq 1 iso 0 dist 7.76707 7.02849 8.56386 10.5622 9.13867 7.97266 numMergedOcc 0
8 mol 123 unq 2 iso 0 dist 7.63425 3.4208 8.56386 11.8318 10.9839 9.28454 numMergedOcc 0
9 mol 123 unq 3 iso 0 dist 7.63425 3.4208 8.56386 10.4007 9.13867 7.97266 numMergedOcc 0
10 mol 131 unq 0 iso 0 dist 8.95717 9.30741 9.09918 6.30762 4.1643 8.89412 numMergedOcc 0
11 mol 133 unq 0 iso 0 dist 4.46578 6.53566 5.9962 6.90904 6.63023 9.63488 numMergedOcc 0
12 mol 133 unq 1 iso 0 dist 4.46578 4.77272 8.61448 6.90904 6.63023 9.31907 numMergedOcc 0
13 mol 163 unq 0 iso 0 dist 9.89864 6.74862 9.21584 13.5904 7.23204 9.48142 numMergedOcc 0
14 mol 204 unq 0 iso 0 dist 7.5696 5.87489 8.40718 11.4202 11.2342 5.67196 numMergedOcc 0
15 mol 250 unq 0 iso 0 dist 9.73318 12.8213 5.43868 16.692 7.05949 7.55313 numMergedOcc 0
16 mol 250 unq 1 iso 0 dist 9.73318 12.8213 5.43868 11.4394 4.69451 8.62074 numMergedOcc 0
17 mol 250 unq 2 iso 0 dist 5.75551 12.8213 9.80833 16.692 13.2963 7.55313 numMergedOcc 0
18 mol 250 unq 3 iso 0 dist 5.75551 12.8213 9.80833 11.4394 10.0219 8.62074 numMergedOcc 0
