0 mol 6 unq 0 iso 0 dist 9.68907 7.46244 12.5999 8.5741 6.30562 11.4509 numMergedOcc 0
1 mol 41 unq 0 iso 0 dist 8.6783 9.3808 8.79418 13.653 8.19484 16.9373 numMergedOcc 0
2 mol 55 unq 0 iso 0 dist 8.57785 5.69981 3.82947 12.0751 8.96507 11.1826 numMergedOcc 0
3 mol 55 unq 1 iso 0 dist 7.03751 9.873 3.82947 9.47026 8.96507 11.1826 numMergedOcc 0
4 mol 79 unq 0 iso 0 dist 9.04935 8.52697 10.0025 10.6431 5.69384 13.133 numMergedOcc 0
5 mol 79 unq 1 iso 0 dist 9.04935 9.66612 10.8249 10.6431 5.69384 15.1522 numMergedOcc 0
6 mol 93 unq 0 iso 0 dist 8.84466 9.43355 3.91263 3.74136 8.42713 7.8435 numMergedOcc 0
7 mol 93 unq 1 iso 0 dist 8.84466 5.64141 5.59024 3.74136 8.42713 5.99269 numMergedOcc 0
8 mol 93 unq 2 iso 0 dist 8.84466 5.46186 12.9872 3.74136 8.42713 5.71763 numMergedOcc 0
9 mol 93 unq 3 iso 0 dist 9.2948 9.43355 15.8131 3.74136 8.21032 7.8435 numMergedOcc 0
10 mol 93 unq 4 iso 0 dist 9.2948 5.64141 13.6266 3.74136 8.21032 5.99269 numMergedOcc 0
11 mol 93 unq 5 iso 0 dist 9.2948 5.46186 5.17052 3.74136 8.21032 5.71763 numMergedOcc 0
12 mol 103 unq 0 iso 0 dist 6.79564 6.6142 3.86836 12.0156 9.7171 13.3692 numMergedOcc 0
13 mol 147 unq 0 iso 0 dist 5.70772 8.73613 11.5768 5.78019 6.4752 9.43989 numMergedOcc 0
14 mol 147 unq 1 iso 0 dist 8.93916 8.10157 16.3583 5.88056 6.4752 12.2104 numMergedOcc 0
15 mol 159 unq 0 iso 0 dist 9.04205 9.31829 6.30259 11.4951 9.91132 11.8647 numMergedOcc 0
16 mol 159 unq 1 iso 0 dist 9.04205 9.31829 6.30259 6.02267 9.90625 6.07821 numMergedOcc 0
17 mol 169 unq 0 iso 0 dist 8.56204 8.66311 14.9735 5.78448 6.29631 14.2312 numMergedOcc 0
18 mol 173 unq 0 iso 0 dist 7.76856 5.82174 9.35913 5.86572 5.76772 10.3478 numMergedOcc 0
19 mol 181 unq 0 iso 0 dist 8.94464 9.19831 7.88733 5.80934 9.91705 12.9134 numMergedOcc 0
20 mol 181 unq 1 iso 0 dist 8.92685 7.83476 5.31548 5.27973 7.92476 9.07638 numMergedOcc 0
21 mol 186 unq 0 iso 0 dist 4.85577 7.81696 3.85767 6.14396 9.93045 12.1449 numMergedOcc 0
22 mol 266 unq 0 iso 0 dist 6.86805 9.1946 8.9784 5.81384 9.39659 14.6911 numMergedOcc 0
23 mol 266 unq 1 iso 0 dist 6.86805 9.1946 8.9784 7.90451 8.25445 15.7165 numMergedOcc 0
24 mol 279 unq 0 iso 0 dist 5.49794 5.35326 3.77031 4.81143 5.63154 5.8304 numMergedOcc 0
